#METABOLOMICS WORKBENCH nishastephan_20161114_000119 DATATRACK_ID:776 STUDY_ID:ST000508 ANALYSIS_ID:AN000777 PROJECT_ID:PR000381 VERSION 1 CREATED_ON December 2, 2016, 11:11 am #PROJECT PR:PROJECT_TITLE Metabolic Profiling of Date Palm Fruits PR:PROJECT_SUMMARY The goal of this study was to investigate metabotypes of date palm fruits PR:PROJECT_SUMMARY through global, non-targeted metabolomics of assorted date fruits varieties from PR:PROJECT_SUMMARY different countries of origin. PR:INSTITUTE Weill Cornell Medicine Qatar PR:DEPARTMENT Bioinformatics Core PR:LABORATORY Suhre Lab PR:LAST_NAME Suhre PR:FIRST_NAME Karsten PR:ADDRESS Luqta Street, Education City, Doha, Qatar, 24144, Qatar PR:EMAIL nishastephan@gmail.com PR:PHONE +97444928281 PR:FUNDING_SOURCE Funding for this research was provided by Qatar National Research Fund, a member PR:FUNDING_SOURCE of Qatar Foundation under the National Priorities Research Program – PR:FUNDING_SOURCE Exceptional Award (NPRP-EP) NPRPX-014-4-001. #STUDY ST:STUDY_TITLE Metabolic Profiling of Date Palm Fruits ST:STUDY_SUMMARY In this study, two independent large cohorts of mature dates exhibiting ST:STUDY_SUMMARY substantial diversity in origin, varieties and fruit processing conditions were ST:STUDY_SUMMARY measured by metabolomics techniques in order to identify major determinants of ST:STUDY_SUMMARY the fruit metabotype. Additional samples reflecting different stages of date ST:STUDY_SUMMARY fruit ripening process has been included for 10 different fruit varieties. ST:INSTITUTE Weill Cornell Medicine in Qatar ST:DEPARTMENT Bioinformatics Core ST:LABORATORY Suhre Lab ST:LAST_NAME Suhre ST:FIRST_NAME Karsten ST:ADDRESS Education City ST:EMAIL nis2034@qatar-med.cornell.edu ST:PHONE +97433888408 #SUBJECT SU:SUBJECT_TYPE Date palm fruit SU:SUBJECT_SPECIES Phoenix dactylifera SU:TAXONOMY_ID 42345 #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS 1 1.2 date_variety:Aseela country_of_origin=Dubai, UAE; brand_name=Dr Ahmad Saif Al-Fasi farm; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 1 1.3 date_variety:Aseela country_of_origin=Dubai, UAE; brand_name=Dr Ahmad Saif Al-Fasi farm; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 2 2.2 date_variety:Piarom, Grade 1 country_of_origin=Iran; brand_name=Zargarzadeh.com; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 4 4.1 date_variety:Rabee country_of_origin=Iran; brand_name=Zargarzadeh.com; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 4 4.2 date_variety:Rabee country_of_origin=Iran; brand_name=Zargarzadeh.com; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 5 5.2 date_variety:Khasoy country_of_origin=Iran; brand_name=Zargarzadeh.com; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 5 5.3 date_variety:Khasoy country_of_origin=Iran; brand_name=Zargarzadeh.com; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 6 6.2 date_variety:Ayash country_of_origin=UAE; brand_name=Date Palm Friends Society; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 7 7.2 date_variety:Mumtaza country_of_origin=UAE; brand_name=Date Palm Friends Society; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 7 7.3 date_variety:Mumtaza country_of_origin=UAE; brand_name=Date Palm Friends Society; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 8 8.1 date_variety:Nawader country_of_origin=UAE; brand_name=Date Palm Friends Society; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 8 8.3 date_variety:Nawader country_of_origin=UAE; brand_name=Date Palm Friends Society; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 9 9.1 date_variety:Zamlee country_of_origin=KSA; brand_name=Date Palm Friends Society; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 9 9.3 date_variety:Zamlee country_of_origin=KSA; brand_name=Date Palm Friends Society; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 10 10.2 date_variety:Sheshe country_of_origin=UAE; brand_name=Azaad Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 10 10 date_variety:Sheshe country_of_origin=UAE; brand_name=Azaad Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 11 11.1 date_variety:Menefi country_of_origin=UAE; brand_name=Azaad Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 11 11.3 date_variety:Menefi country_of_origin=UAE; brand_name=Azaad Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 11 11 date_variety:Menefi country_of_origin=UAE; brand_name=Azaad Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 12 12.1 date_variety:Berni country_of_origin=UAE; brand_name=Al Danayeh; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 12 12.3 date_variety:Berni country_of_origin=UAE; brand_name=Al Danayeh; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 13 13.2 date_variety:Ambara country_of_origin=UAE; brand_name=Al Danayeh; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 14 14.1 date_variety:Sultana country_of_origin=UAE; brand_name=Al Danayeh; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 14 14.2 date_variety:Sultana country_of_origin=UAE; brand_name=Al Danayeh; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 15 15.3 date_variety:Jabri country_of_origin=UAE; brand_name=Al Danayeh; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 16 16.1 date_variety:BuMaan country_of_origin=UAE; brand_name=Al Danayeh; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 16 16.2 date_variety:BuMaan country_of_origin=UAE; brand_name=Al Danayeh; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 17 17.3 date_variety:Safawin country_of_origin=UAE; brand_name=Al Danayeh; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 18 18.2 date_variety:Saeedi country_of_origin=Egypt; brand_name=Orient; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 18 18.3 date_variety:Saeedi country_of_origin=Egypt; brand_name=Orient; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 19 19.3 date_variety:Gagee country_of_origin=Egypt; brand_name=Orient; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 20 20.2 date_variety:Ghazelee country_of_origin=Egypt; brand_name=Orient; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 20 20.3 date_variety:Ghazelee country_of_origin=Egypt; brand_name=Orient; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 21 21.3 date_variety:Malakabi country_of_origin=Egypt; brand_name=Orient; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 22 22.2 date_variety:Ibrahim ( Iraqi Ajwa) country_of_origin=Iraq; brand_name=Al Basra Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 22 22 date_variety:Ibrahim ( Iraqi Ajwa) country_of_origin=Iraq; brand_name=Al Basra Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 23 23.1 date_variety:Um Alamod country_of_origin=Iraq; brand_name=Al Basra Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 23 23.3 date_variety:Um Alamod country_of_origin=Iraq; brand_name=Al Basra Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 24 24.2 date_variety:Khiyara country_of_origin=Iraq; brand_name=Al Basra Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 24 24.3 date_variety:Khiyara country_of_origin=Iraq; brand_name=Al Basra Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 24 24 date_variety:Khiyara country_of_origin=Iraq; brand_name=Al Basra Dates; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 25 25.2 date_variety:Barani country_of_origin=Pakistan; brand_name=Sindh Board of Investment (SBI); collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 26 26.1 date_variety:Sangol country_of_origin=Pakistan; brand_name=Sindh Board of Investment (SBI); collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 26 26.2 date_variety:Sangol country_of_origin=Pakistan; brand_name=Sindh Board of Investment (SBI); collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 27 27.2 date_variety:Aseel country_of_origin=Pakistan; brand_name=Sindh Board of Investment (SBI); collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 27 27.3 date_variety:Aseel country_of_origin=Pakistan; brand_name=Sindh Board of Investment (SBI); collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 27 27 date_variety:Aseel country_of_origin=Pakistan; brand_name=Sindh Board of Investment (SBI); collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 28 28.3 date_variety:Gorakh country_of_origin=Pakistan; brand_name=Sindh Board of Investment (SBI); collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 29 29.1 date_variety:Zayaki country_of_origin=Pakistan; brand_name=Sindh Board of Investment (SBI); collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 29 29.3 date_variety:Zayaki country_of_origin=Pakistan; brand_name=Sindh Board of Investment (SBI); collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 30 30.3 date_variety:Burmeel country_of_origin=Libya; brand_name=Al-Nakhlatain; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 30 30 date_variety:Burmeel country_of_origin=Libya; brand_name=Al-Nakhlatain; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 31 31.2 date_variety:Berni country_of_origin=Libya; brand_name=Al-Nakhlatain; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 31 31.3 date_variety:Berni country_of_origin=Libya; brand_name=Al-Nakhlatain; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 32 32.1 date_variety:Abel country_of_origin=Libya; brand_name=Al-Nakhlatain; collection_info=Abu Dhabi Date Palm Festival 2012 SUBJECT_SAMPLE_FACTORS 34 34.1 date_variety:Sagai dry country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 34 34.3 date_variety:Sagai dry country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 35 35.2 date_variety:Khudry country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 36 36.3 date_variety:Ajwa medina country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 37 37.2 date_variety:Safawi - medina country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 37 37.3 date_variety:Safawi - medina country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 38 38.1 date_variety:Sagai - Rotab country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 38 38.3 date_variety:Sagai - Rotab country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 39 39.1 date_variety:Rushydia country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 40 40.1 date_variety:Naboot Sultan country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 40 40.3 date_variety:Naboot Sultan country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 41 41.1 date_variety:Sufri country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 41 41.3 date_variety:Sufri country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 42 42.1 date_variety:Shieshi Rotab country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 42 42.3 date_variety:Shieshi Rotab country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 43 43.3 date_variety:khlas country_of_origin=Qatar; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 44 44.1 date_variety:Mabroom country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 44 44.2 date_variety:Mabroom country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 44 44 date_variety:Mabroom country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 45 45.1 date_variety:Medjoul country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 46 46.1 date_variety:Naboot Ali country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 46 46.2 date_variety:Naboot Ali country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 47 47.1 date_variety:Amber - medina country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 47 47.2 date_variety:Amber - medina country_of_origin=KSA; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 48 48.1 date_variety:Mabroom country_of_origin=Qatar; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 49 49.2 date_variety:Sukary country_of_origin=Qatar; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 49 49.3 date_variety:Sukary country_of_origin=Qatar; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 50 50.1 date_variety:Khudry country_of_origin=Qatar; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 50 50 date_variety:Khudry country_of_origin=Qatar; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 51 51.2 date_variety:Dried dates country_of_origin=Qatar; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 51 51.3 date_variety:Dried dates country_of_origin=Qatar; brand_name=Al Qaseem Dates; collection_info=Al Qaseem Dates store SUBJECT_SAMPLE_FACTORS 52 52.1 date_variety:Sufri country_of_origin=Qatar; brand_name=National Food Company; collection_info=Carrefour SUBJECT_SAMPLE_FACTORS 52 52.3 date_variety:Sufri country_of_origin=Qatar; brand_name=National Food Company; collection_info=Carrefour SUBJECT_SAMPLE_FACTORS 53 53.2 date_variety:Safawi country_of_origin=KSA; brand_name=Carrefour; collection_info=Carrefour SUBJECT_SAMPLE_FACTORS 54 54.1 date_variety:Mabroom country_of_origin=KSA; brand_name=Carrefour; collection_info=Carrefour SUBJECT_SAMPLE_FACTORS 54 54.2 date_variety:Mabroom country_of_origin=KSA; brand_name=Carrefour; collection_info=Carrefour SUBJECT_SAMPLE_FACTORS 55 55.3 date_variety:Kheneizi country_of_origin=KSA; brand_name=Date Crown; collection_info=Carrefour SUBJECT_SAMPLE_FACTORS 56 56.1 date_variety:Suqai country_of_origin=Qatar; brand_name=National Food Company; collection_info=Lulu SUBJECT_SAMPLE_FACTORS 57 57.2 date_variety:Safawi country_of_origin=KSA; brand_name=Al Alwani Dates; collection_info=Lulu SUBJECT_SAMPLE_FACTORS 57 57.3 date_variety:Safawi country_of_origin=KSA; brand_name=Al Alwani Dates; collection_info=Lulu SUBJECT_SAMPLE_FACTORS 58 58.3 date_variety:Sagai country_of_origin=UAE; brand_name=Liwa Dates; collection_info=Lulu SUBJECT_SAMPLE_FACTORS 60 60.2 date_variety:Allig country_of_origin=Tunisia; brand_name=Personal collection; collection_info=Eman Mabrook - BCQ SUBJECT_SAMPLE_FACTORS 60 60 date_variety:Allig country_of_origin=Tunisia; brand_name=Personal collection; collection_info=Eman Mabrook - BCQ SUBJECT_SAMPLE_FACTORS 61 61.1 date_variety:Hamrata country_of_origin=Tunisia; brand_name=Personal collection; collection_info=Eman Mabrook - BCQ SUBJECT_SAMPLE_FACTORS 61 61.3 date_variety:Hamrata country_of_origin=Tunisia; brand_name=Personal collection; collection_info=Eman Mabrook - BCQ SUBJECT_SAMPLE_FACTORS 61 61 date_variety:Hamrata country_of_origin=Tunisia; brand_name=Personal collection; collection_info=Eman Mabrook - BCQ SUBJECT_SAMPLE_FACTORS 62 62.2 date_variety:Grenja country_of_origin=Tunisia; brand_name=Personal collection; collection_info=Eman Mabrook - BCQ SUBJECT_SAMPLE_FACTORS 64 64.2 date_variety:Deglet Nour country_of_origin=Tunisia; brand_name=Personal collection; collection_info=Eman Mabrook - BCQ SUBJECT_SAMPLE_FACTORS 64 64.3 date_variety:Deglet Nour country_of_origin=Tunisia; brand_name=Personal collection; collection_info=Eman Mabrook - BCQ SUBJECT_SAMPLE_FACTORS 69 69.3 date_variety:Medjoul country_of_origin=California, USA; brand_name=Spinneys; collection_info=Spinneys SUBJECT_SAMPLE_FACTORS 70 70.2 date_variety:Sukkary country_of_origin=KSA; brand_name=Personal collection; collection_info=Personal collection -Mashael Al Shafai SUBJECT_SAMPLE_FACTORS 71 71 date_variety:Fegous-ghlid country_of_origin=Morocco; brand_name=Marrakech Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 72 72 date_variety:Majhool AA country_of_origin=Morocco; brand_name=Marrakech Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 73 73 date_variety:Jihl country_of_origin=Morocco; brand_name=Marrakech Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 74 74 date_variety:Tadment country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 75 75 date_variety:Sayer country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 77 77 date_variety:Hafs country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 78 78 date_variety:Bouzagza country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 79 79 date_variety:Boukhanda country_of_origin=Morocco; brand_name=Fess Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 80 80 date_variety:Agalid country_of_origin=Morocco; brand_name=Fess Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 81 81 date_variety:Lakhal country_of_origin=Morocco; brand_name=Fess Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 82 82 date_variety:Najda country_of_origin=Morocco; 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brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 87 87C date_variety:Tazgaghzt country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 88 88 date_variety:Tamaright 2 country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 89 89E date_variety:khalt-lhammar country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 89 89 date_variety:khalt-lhammar country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 89 89C date_variety:khalt-lhammar country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 89 89D date_variety:khalt-lhammar country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 89 89A date_variety:khalt-lhammar country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 89 89B date_variety:khalt-lhammar country_of_origin=Morocco; brand_name=Ourzazet Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 90 90 date_variety:Mejhool country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 90 90A date_variety:Mejhool country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 90 90B date_variety:Mejhool country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 90 90C date_variety:Mejhool country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 91 91F date_variety:Belahzit country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 91 91 date_variety:Belahzit country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 91 91A date_variety:Belahzit country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 91 91H date_variety:Belahzit country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 92 92E date_variety:Shetwia country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 92 92 date_variety:Shetwia country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 92 92A date_variety:Shetwia country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 92 92B1 date_variety:Shetwia country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 92 92C date_variety:Shetwia country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 92 92D date_variety:Shetwia country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 93 93C date_variety:Booserdoon country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 93 93 date_variety:Booserdoon country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 93 93D date_variety:Booserdoon country_of_origin=Morocco; brand_name=Awfous Souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 96 96 date_variety:Bekri-khder country_of_origin=Morocco; brand_name=Ourzazet souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 97 97A date_variety:Tahmoot 2 country_of_origin=Morocco; brand_name=Arfoud souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 97 97B date_variety:Tahmoot 2 country_of_origin=Morocco; brand_name=Arfoud souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 97 97C date_variety:Tahmoot 2 country_of_origin=Morocco; brand_name=Arfoud souq; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 98 98 date_variety:Boufegous rqiq country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 99 99D date_variety:Maajoun country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 99 99B date_variety:Maajoun country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 99 99C date_variety:Maajoun country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 99 99A date_variety:Maajoun country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 100 100 date_variety:Boussakri country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 101 101 date_variety:Admoo country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 103 103B date_variety:Tarzawa country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 103 103C date_variety:Tarzawa country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 103 103A date_variety:Tarzawa country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 104 104 date_variety:Boozekri country_of_origin=Morocco; brand_name=Mghalba oasis; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 105 105 date_variety:Zaghlool country_of_origin=Egypt; brand_name=Hyat Plaza mall, Doha; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 108 108 date_variety:Deglet Bayda country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 109 109 date_variety:Deglet Nour Hourra country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 112 112 date_variety:Adam adaalee country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 113 113 date_variety:Tantebouchte country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 114 114 date_variety:Fegous country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 117 117 date_variety:Deglet Nour country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 119 119 date_variety:Telemsoua country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 120 120 date_variety:Adam bujamaa country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 122 122 date_variety:Tamjhourt country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 124 124 date_variety:Gharss country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 125 125 date_variety:Ddagla country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 126 126 date_variety:Tagarbushet country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 128 128 date_variety:Deglet country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 129 129 date_variety:Adam admaan country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 131 131 date_variety:Hameera country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 133 133 date_variety:Hamray country_of_origin=Algeria; brand_name=-; collection_info=Morocco Trip 2013 SUBJECT_SAMPLE_FACTORS 136 136 date_variety:Zehdi country_of_origin=Jordan; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 137 137 date_variety:Lulu country_of_origin=Jordan; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 139 139 date_variety:Siwa country_of_origin=Egypt; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 141 141 date_variety:Saeedi country_of_origin=Libya; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 142 142 date_variety:Kulma soda country_of_origin=Sudan; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 143 143 date_variety:Grundeela/Qundeil country_of_origin=Sudan; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 144 144 date_variety:Barakawi country_of_origin=Sudan; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 145 145 date_variety:Sultana Bedeen country_of_origin=Sudan; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 146 146 date_variety:Aydea Al Qaseem country_of_origin=KSA; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 147 147 date_variety:Qatarah/Kattara country_of_origin=UAE; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 148 148 date_variety:Msalla country_of_origin=UAE; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 149 149 date_variety:Dabbas country_of_origin=UAE; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 150 150 date_variety:Sillege country_of_origin=UAE; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 SUBJECT_SAMPLE_FACTORS 151 151 date_variety:Harmayi Sadrati country_of_origin=Iran; brand_name=-; collection_info=Abu Dhabi Date Palm Festival 2013 #COLLECTION CO:COLLECTION_SUMMARY In the present study, 123 unique date varieties (Phoenix dactylifera) from 14 CO:COLLECTION_SUMMARY countries were collected in two separate occasions: A first collection took part CO:COLLECTION_SUMMARY in 2012 (DS1) and the second one in 2013 (DS2). The term variety is used here to CO:COLLECTION_SUMMARY describe a distinct phenotypic class of dates and if the same variety was CO:COLLECTION_SUMMARY collected from different countries, a different sample ID was assigned to each CO:COLLECTION_SUMMARY collected sample per country. Overall, dates from the first sample collection CO:COLLECTION_SUMMARY were mostly from the Gulf region obtained in a fairly dried condition from shops CO:COLLECTION_SUMMARY and festivals whilst the second sample collection was dominated by North African CO:COLLECTION_SUMMARY dates obtained mostly fresh from the palm trees. For the second collection of CO:COLLECTION_SUMMARY dates, field work permissions were obtained verbally from owners of visited CO:COLLECTION_SUMMARY oases. The marketed versus fresh nature of dates between the two sample CO:COLLECTION_SUMMARY collections implies varying post-harvest conditions. All collected dates with CO:COLLECTION_SUMMARY homogenous brown color were further dried by exposing them to open air for two CO:COLLECTION_SUMMARY weeks before further processing. With the second sample collection, while CO:COLLECTION_SUMMARY harvesting ripened fruits from the palm trees, immature fruits still undergoing CO:COLLECTION_SUMMARY ripening activity and occasionally late green Kimri fruits from the pre-ripening CO:COLLECTION_SUMMARY stage were collected when available. In total, 37 immature date fruits, CO:COLLECTION_SUMMARY corresponding to 10 date samples, were collected. With each of the 10 samples, CO:COLLECTION_SUMMARY the immature fruits were ranked by their extent of ripening based on visual CO:COLLECTION_SUMMARY assessment of color change and skin wrinkling. Each fruit was given an ID based CO:COLLECTION_SUMMARY on a combination of the sample number and a letter reflecting the fruit rank CO:COLLECTION_SUMMARY within the sample. In general, dates were considered mature if the low moisture CO:COLLECTION_SUMMARY prevented any further change in their appearance. Notably, maturity is attained CO:COLLECTION_SUMMARY naturally with the dry class of dates but often artificially with the soft class CO:COLLECTION_SUMMARY of dates owing to intrinsically higher moisture levels. CO:SAMPLE_TYPE Date palm fruit CO:COLLECTION_LOCATION Differnt locations specified in the CO:COLLECTION_DURATION 2012 - 2013 CO:STORAGE_CONDITIONS -80C #TREATMENT TR:TREATMENT_SUMMARY The aim of this study was to determine metabolic phenotype of the date palm TR:TREATMENT_SUMMARY fruits without any treatment at the baseline. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Sample pre-processing for DS1: 50 mg of the peel and flesh of the date fruits SP:SAMPLEPREP_SUMMARY were flash frozen in liquid nitrogen and extracted as previously described SP:SAMPLEPREP_SUMMARY (PMID:21699588). Sample pre-processing for DS2 The beads were added to the SP:SAMPLEPREP_SUMMARY pre-weighed frozen samples together with water (8 µL of per mg of sample) for SP:SAMPLEPREP_SUMMARY homogenisation. The samples were continuously stirred on the GenoGrinder (Glen SP:SAMPLEPREP_SUMMARY Mills GenoGrinder 2000, Germany) at 1000 strokes per minute for five minutes, to SP:SAMPLEPREP_SUMMARY ensure complete homogenization. 100 µL of aliquot from each sample was SP:SAMPLEPREP_SUMMARY transferred to the plates. The samples were loaded on three plates. To each SP:SAMPLEPREP_SUMMARY sample, 450 µL of extraction solvent (MeOH with 10 µL /ml chlorophenylalanine, SP:SAMPLEPREP_SUMMARY 2.5 µL /ml 2-fluorophenylglycine, 25 µg/ml d-6 cholestrol and 25 µL /ml SP:SAMPLEPREP_SUMMARY tridecanoic acid) was added. The samples were then shaken on the GenoGrinder SP:SAMPLEPREP_SUMMARY (GenoGrinder, Spex, USA) at 675 strokes per min for two minutes and centrifuged SP:SAMPLEPREP_SUMMARY at 2000 rpm for 5 minutes on a Beckman centrifuge (Beckman GS-6R Centrifuge, SP:SAMPLEPREP_SUMMARY USA) at 40C. The extracted samples were divided into equal parts for SP:SAMPLEPREP_SUMMARY metabolomics analysis on the Gas Chromatography Mass Spectrometry (GC/MS) and SP:SAMPLEPREP_SUMMARY the Orbitrap Elite accurate Liquid Chromatography Mass Spectrometry2 (LC-MS-MS) SP:SAMPLEPREP_SUMMARY platforms. Four sets of samples were prepared by the Hamilton robot (Hamilton SP:SAMPLEPREP_SUMMARY Star, Germany) by transferring 110 µL aliquots from each well to three PCR SP:SAMPLEPREP_SUMMARY plates, each for LC positive, LC negative, replicate set and one to 250 µL auto SP:SAMPLEPREP_SUMMARY sampler vial inserts for GC. All samples were dried for 120 minutes by using a SP:SAMPLEPREP_SUMMARY Zymark Turbovap 96 (Zymark Turbovap, USA) followed by overnight incubation in a SP:SAMPLEPREP_SUMMARY drybox to ensure optimal dryness of the sample. Sample processing DS1 and DS2 SP:SAMPLEPREP_SUMMARY Metabolite measurements with Ultrahigh Performance Liquid Chromatography/Mass SP:SAMPLEPREP_SUMMARY Spectroscopy (UPLC/MS/MS): The UPLC/MS/MS analysis was based on the Waters SP:SAMPLEPREP_SUMMARY ACUITY ultra performance liquid chromatography (Waters Corporation, USA) and the SP:SAMPLEPREP_SUMMARY ThermoFischer Scientific Orbitrap Elite high-resolution accurate mass SP:SAMPLEPREP_SUMMARY spectrometer (Thermo Fischer Scientific Inc., USA) equipped with a heated SP:SAMPLEPREP_SUMMARY electrospray ionization (HESI) source and an Orbitrap mass analyzer. The dried SP:SAMPLEPREP_SUMMARY sample extracts for the LC positive and LC negative mode were reconstituted in SP:SAMPLEPREP_SUMMARY acidic and basic LC- compatible solvents. Two independent injections were SP:SAMPLEPREP_SUMMARY performed on each sample using separate dedicated columns for optimized acidic SP:SAMPLEPREP_SUMMARY positive ions and the other for optimized basic negative ions. The acidic SP:SAMPLEPREP_SUMMARY samples were reconstituted by gradient elution of water and methanol containing SP:SAMPLEPREP_SUMMARY 0.1 % formic acid whereas; the basic samples were reconstituted by gradient SP:SAMPLEPREP_SUMMARY elution of water and methanol containing 6.5mM ammonium bicarbonate (PMID: SP:SAMPLEPREP_SUMMARY 19624122). The mass spectra analysis alternated between MS and data dependent SP:SAMPLEPREP_SUMMARY MS2 scans using dynamic exclusion. Metabolite measurements with GC/MS: The SP:SAMPLEPREP_SUMMARY samples assigned for the GC/MS analysis were further dried under vacuum SP:SAMPLEPREP_SUMMARY desiccation for an entire day and derivatized under dried nitrogen using SP:SAMPLEPREP_SUMMARY bistrimethyl-silyl-trifluoroacetamide (BSTFA). The GS/MS analysis was based on a SP:SAMPLEPREP_SUMMARY Thermo FinniganTM TRACETM DSQTM (ThermoFinnigan, USA) fast-scanning single SP:SAMPLEPREP_SUMMARY –quadrupole mass spectrophotometer using electron impact ionization source. SP:SAMPLEPREP_SUMMARY The GC column was 5% phenyl and the temperature ramp range was from 40 to 3000 C SP:SAMPLEPREP_SUMMARY in a time span of 16 minutes. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY The 5% diphenyl/ 95% dimethyl polysiloxane GC column and the temperature ramp CH:CHROMATOGRAPHY_SUMMARY was from 40° to 300° C in a 16 minute period. Samples were analyzed on a CH:CHROMATOGRAPHY_SUMMARY Thermo-Finnigan Trace DSQ fast-scanning single-quadrupole mass spectrometer CH:CHROMATOGRAPHY_SUMMARY using electron impact ionization. The instrument was tuned and calibrated for CH:CHROMATOGRAPHY_SUMMARY mass resolution and mass accuracy on a daily basis. CH:CHROMATOGRAPHY_TYPE GC CH:INSTRUMENT_NAME Thermo-Finnigan Trace DSQ fast-scanning single-quadrupole mass spectrometer CH:COLUMN_NAME 5% diphenyl/ 95% dimethyl polysiloxane GC column #ANALYSIS AN:ANALYSIS_TYPE MS AN:LABORATORY_NAME Metabolon, Inc. #MS MS:MS_COMMENTS - MS:INSTRUMENT_NAME Thermo Trace DSQ MS:INSTRUMENT_TYPE Single quadrupole MS:MS_TYPE EI MS:ION_MODE POSITIVE #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Counts per second (cps) MS_METABOLITE_DATA_START Samples 1.2 1.3 2.2 4.1 4.2 5.2 5.3 6.2 7.2 7.3 8.1 8.3 9.1 9.3 10.2 11.1 11.3 12.1 12.3 13.2 14.1 14.2 15.3 16.1 16.2 17.3 18.2 18.3 19.3 20.2 20.3 21.3 22.2 23.1 23.3 24.2 24.3 25.2 26.1 26.2 27.2 27.3 28.3 29.1 29.3 30.3 31.2 31.3 32.1 34.1 34.3 35.2 36.3 37.2 37.3 38.1 38.3 39.1 40.1 40.3 41.1 41.3 42.1 42.3 43.3 44.1 44.2 45.1 46.1 46.2 47.1 47.2 48.1 49.2 49.3 50.1 51.2 51.3 52.1 52.3 53.2 54.1 54.2 55.3 56.1 57.2 57.3 58.3 60.2 61.1 61.3 62.2 64.2 64.3 69.3 70.2 83 75 103B 73 113 85 93C 85A 122 78 97A 90 103C 142 87 86 89E 80 109 89 74 148 44 139 89C 147 60 77 82 146 27 91F 136 101 89D 117 10 99D 91 125 149 84 96 11 108 61 87B 99B 145 99C 128 100 71 150 92E 144 88 85C 87C 137 143 119 90A 92 99A 50 103A 114 124 131 133 126 89A 89B 97B 97C 93 30 141 91A 105 151 22 24 81 92A 92B1 92C 92D 112 129 120 90B 90C 93D 72 104 98 79 91H Factors date_variety:Aseela date_variety:Aseela date_variety:Piarom, Grade 1 date_variety:Rabee date_variety:Rabee date_variety:Khasoy date_variety:Khasoy date_variety:Ayash date_variety:Mumtaza date_variety:Mumtaza date_variety:Nawader date_variety:Nawader date_variety:Zamlee date_variety:Zamlee date_variety:Sheshe date_variety:Menefi date_variety:Menefi date_variety:Berni date_variety:Berni date_variety:Ambara date_variety:Sultana date_variety:Sultana date_variety:Jabri date_variety:BuMaan date_variety:BuMaan date_variety:Safawin date_variety:Saeedi date_variety:Saeedi date_variety:Gagee date_variety:Ghazelee date_variety:Ghazelee date_variety:Malakabi date_variety:Ibrahim ( Iraqi Ajwa) date_variety:Um Alamod date_variety:Um Alamod date_variety:Khiyara date_variety:Khiyara date_variety:Barani date_variety:Sangol date_variety:Sangol date_variety:Aseel date_variety:Aseel date_variety:Gorakh date_variety:Zayaki date_variety:Zayaki date_variety:Burmeel date_variety:Berni date_variety:Berni date_variety:Abel date_variety:Sagai dry date_variety:Sagai dry date_variety:Khudry date_variety:Ajwa medina date_variety:Safawi - medina date_variety:Safawi - medina date_variety:Sagai - Rotab date_variety:Sagai - Rotab date_variety:Rushydia date_variety:Naboot Sultan date_variety:Naboot Sultan date_variety:Sufri date_variety:Sufri date_variety:Shieshi Rotab date_variety:Shieshi Rotab date_variety:khlas date_variety:Mabroom date_variety:Mabroom date_variety:Medjoul date_variety:Naboot Ali date_variety:Naboot Ali date_variety:Amber - medina date_variety:Amber - medina date_variety:Mabroom date_variety:Sukary date_variety:Sukary date_variety:Khudry date_variety:Dried dates date_variety:Dried dates date_variety:Sufri date_variety:Sufri date_variety:Safawi date_variety:Mabroom date_variety:Mabroom date_variety:Kheneizi date_variety:Suqai date_variety:Safawi date_variety:Safawi date_variety:Sagai date_variety:Allig date_variety:Hamrata date_variety:Hamrata date_variety:Grenja date_variety:Deglet Nour date_variety:Deglet Nour date_variety:Medjoul date_variety:Sukkary date_variety:Wahardan date_variety:Sayer date_variety:Tarzawa date_variety:Jihl date_variety:Tantebouchte date_variety:Azaghzaw date_variety:Booserdoon date_variety:Azaghzaw date_variety:Tamjhourt date_variety:Bouzagza date_variety:Tahmoot 2 date_variety:Mejhool date_variety:Tarzawa date_variety:Kulma soda date_variety:Tazgaghzt date_variety:Bouslikh date_variety:khalt-lhammar date_variety:Agalid date_variety:Deglet Nour Hourra date_variety:khalt-lhammar date_variety:Tadment date_variety:Msalla date_variety:Mabroom date_variety:Siwa date_variety:khalt-lhammar date_variety:Qatarah/Kattara date_variety:Allig date_variety:Hafs date_variety:Najda date_variety:Aydea Al Qaseem date_variety:Aseel date_variety:Belahzit date_variety:Zehdi date_variety:Admoo date_variety:khalt-lhammar date_variety:Deglet Nour date_variety:Sheshe date_variety:Maajoun date_variety:Belahzit date_variety:Ddagla date_variety:Dabbas date_variety:Bid-djaj date_variety:Bekri-khder date_variety:Menefi date_variety:Deglet Bayda date_variety:Hamrata date_variety:Tazgaghzt date_variety:Maajoun date_variety:Sultana Bedeen date_variety:Maajoun date_variety:Deglet date_variety:Boussakri date_variety:Fegous-ghlid date_variety:Sillege date_variety:Shetwia date_variety:Barakawi date_variety:Tamaright 2 date_variety:Azaghzaw date_variety:Tazgaghzt date_variety:Lulu date_variety:Grundeela/Qundeil date_variety:Telemsoua date_variety:Mejhool date_variety:Shetwia date_variety:Maajoun date_variety:Khudry date_variety:Tarzawa date_variety:Fegous date_variety:Gharss date_variety:Hameera date_variety:Hamray date_variety:Tagarbushet date_variety:khalt-lhammar date_variety:khalt-lhammar date_variety:Tahmoot 2 date_variety:Tahmoot 2 date_variety:Booserdoon date_variety:Burmeel date_variety:Saeedi date_variety:Belahzit date_variety:Zaghlool date_variety:Harmayi Sadrati date_variety:Ibrahim ( Iraqi Ajwa) date_variety:Khiyara date_variety:Lakhal date_variety:Shetwia date_variety:Shetwia date_variety:Shetwia date_variety:Shetwia date_variety:Adam adaalee date_variety:Adam admaan date_variety:Adam bujamaa date_variety:Mejhool date_variety:Mejhool date_variety:Booserdoon date_variety:Majhool AA date_variety:Boozekri date_variety:Boufegous rqiq date_variety:Boukhanda date_variety:Belahzit 1-kestose 82036920 202965440 25201326 50585864 11301948 31720110 179095472 44927916 11590327 40023784 13623884 11712277 1195455104 1075516928 155493760 56584364 80165520 112101112 126075736 38343856 19557852 33624372 2044862.75 30854734 9018159 104621320 80219464 71176008 152312416 564456128 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25871010 345336128 107468608 22580944 16955460 113101944 19884900 63588912 524819520 2138042 2735952 2123356 118184704 74445456 118706392 103473768 94854056 49341524 3885916 59366668 9498833 2564764 12788239 67105772 24322628 14030043 2046328 22839576 18388958 9572484 82275344 9954899 168418512 403900736 39789984 174811824 1025622784 134345 28580508 21940866 3264390 10722984 16743903 487217600 102015504 90460640 5030954 14272723 40239700 33133456 40014844 219973824 29799908 62516864 1962430 108178960 563323520 1-palmitoylglycerol (1-monopalmitin) NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL 41065 0 169542 91498 176234 65400 180797 0 0 75474 85787 50499 64296 209435 157688 145103 104099 176213 160127 85894 59592 215635 0 58694 281334 138264 0 210929 177415 80562 88547 199618 0 128053 365215 189849 254888 79986 144826 236223 171436 81012 84820 0 229891 220935 88657 88303 208676 62214 0 243341 0 0 149362 325638 132143 119849 178722 168855 204610 114874 172444 76294 67197 151484 132885 73385 89690 0 104998 209924 33897 0 59829 165025 129631 0 157120 77808 224724 0 194676 0 59984 112670 45758 171792 273064 0 196753 346677 138705 122233 167106 51379 110218 0 0 114899 1,2-propanediol 7888273.5 11310084 8181007.5 9090030 6693310 12982275 10633973 8635025 7925216 6360586 4816399 9050424 10843138 7898496.5 10889816 9368453 9787306 6617839.5 6172629 8521367 10185075 9081522 7243497 9073014 185131728 9985893 5364253 10156193 10090769 10879924 12560181 9567148 10429132 10628158 11281147 6106700.5 8021459 6892627 6567467 393191200 8964737 17148860 16432317 6683884.5 9495270 409224320 5125176.5 5755533.5 6669109.5 9413443 11236899 9362110 6810238.5 4544341.5 7021964 167870272 223169264 15173721 7158922.5 5715985 10325830 9732289 9113368 10273583 9003152 8069136 8026598 12150764 11090134 14242338 7622524 8160774.5 7409867.5 7151113.5 9081522 6893583 9900889 12087223 9927666 8236622 6798221 8086152 6749663.5 8918686 8097489 12048274 4149193.75 9110981 8709967 14081340 8748934 872518272 8605099 11332848 103575800 9268978 3679389 2357501 2162135 3225784 2604853 1755598 1475321 773538 1814259 3335246 991431 2261033 8544535 2655175 2425192 1960574 1032822 1629077 2289428 1957997 1485011 1590543 2471760 1036020 1041730 1387735 2854437 2870174 17810514 1850167 2034964 968285 1338405 2142949 1071603 1923469 1817426 1500047 2212517 1702076 1079457 3487930 1502720 2635850 2672638 3026387 2275846 1471069 1701705 1783563 1616971 1501584 2991858 871554 6300984 2669243 2869832 1210271 1404213 1274782 2127567 1506994 1231274 1758168 722146 2077060 3265939 1605124 1896396 1208892 1612549 2736499 853691 1190429 5075896 1030656 1376831 2701022 1328459 1121189 871842 954395 4248371 4808136 2455711 894314 1314745 1386256 1957676 1900130 1222117 2842823 831745 934785 1311965 1758168 2613035 1339626 2026859 1373719 1,3-dihydroxyacetone 21101528 25686726 27890686 26141202 20869934 20523534 23525254 24997044 22304706 21140432 23459714 17330626 21904338 19469946 18111654 23675130 29852104 27498826 28137132 29421226 20147216 27185124 12363992 18991380 22161362 31261548 23427084 13152431 14193632 39278504 22746340 24656096 22676980 11549043 21432126 31533856 15065206 25799744 21681832 12537918 28858788 37082100 21300506 9371464 15980731 15917989 11307424 30313356 28474912 25915022 22746340 22304780 33302296 17021806 20356860 32300072 32360596 32674630 20704012 22541842 23707216 24654760 19630440 19620224 16002951 19908632 23891062 30157440 14937866 14256889 26116118 40578112 21386172 7561770.5 9966208 20200432 22826164 27976448 27556278 32292846 31880852 25497168 22291248 22631250 30048178 23522898 18141494 23187972 23449402 24473936 29343348 28228846 12629885 20163854 25261884 9756081 2610016 3973104 5421920 11499712 17748148 10039567 6524869 3828053 8319248 9752953 1817224 7239015 2313595 20401280 12647497 5326940 1637927 13743526 5127923 8208833 18741174 21568662 14464238 12663975 1386102 18243410 18311064 6772626 9711568 9077147 15955006 7609487 18755908 24044856 2395141 3738786 24385156 17202798 6239997 8859133 13209992 14037405 9789694 10415712 9568304 16128325 18852904 1198183 16197228 6509326 9446249 18903294 31524594 4413960 9157773 28265396 9798032 10266901 13293132 16076494 15947609 13946132 4626837 2904542 281144 11344231 6222327 5056201 8270277 5912774 4980580 12181916 904963 1153696 6330546 9670185 16746039 5280891 23817870 6344138 9711568 10203361 9092436 13784921 12725091 830476 2588402 4480326 18537608 11119622 10510424 18135428 6083419 11493288 4591620 5233572 9991886 5448119 18926610 11154911 2-aminobutyrate 1854865 967027.0625 933141 298675 1436192.875 0 0 1440649.875 1534402.125 1234017.25 573660.375 1698533.375 48981192 38664216 458202.6875 1266017.25 536415.75 0 909206.9375 0 0 738565.9375 573911.875 0 0 0 728110.25 307970.6875 943093 0 1468148.125 310843.7188 1766908.25 0 0 0 548917.25 1038204.5 1029041.75 1141500.75 0 218490.3906 239290.1406 599523.25 662424.5625 704792.0625 0 484496.2188 580499.0625 0 1112894 0 443987.875 497162.8438 938117 1686779.875 1274049.75 690981.375 506030.125 664979.75 0 146145.9219 1752502 2245813 0 490014.75 1081361.125 0 0 0 760854.8125 3751809.75 474607.9063 1995936.375 2091218.125 0 0 0 367370.7188 0 684238.875 0 0 1071350.75 864360.3125 0 737733.875 0 1201406.875 1421403.75 1854437.5 1529129.75 1498014.875 802269.8125 2579098.75 3315993 95758 385699 0 280330 177943 56355 0 158022 572060 1029288 0 249581 0 103034 502811 110201 185074 525629 228934 49324 56013 0 167867 302617 411664 59303 497036 208996 0 279081 65187 53493 187834 180738 236330 259461 169021 286215 118593 0 128169 692895 423316 197310 433755 496770 0 316797 127137 400335 329731 279163 1777203 205487 514087 107521 357646 0 0 204203 72428 382582 128198 494159 1846743 97307 67814 1846047 360174 874763 425820 143427 238234 301071 70897 114611 166772 267622 315824 186554 341094 669459 224005 242046 920388 4010089 1504107 105479 1397574 2260736 214111 131515 253393 86557 176811 304576 64003 227007 386333 353188 2-hydroxybutyrate (AHB) 690135.0625 1048629.75 2797498.5 7244234 5645930.5 3772393.5 3908461 5956181.5 6215369 5670123 13909177 11441862 6108894 3919902.75 7649748 1805819.375 2363594.75 11075462 5607377 6517957.5 7124757 5020379 2921916.25 7819038.5 9352495 2321552.5 2688960.75 3244394.75 509336.0313 1439555.75 634350.0625 507346.2188 3605400 544415.8125 717295.125 4688883.5 3367349 2322564.25 6749221 3753221.75 2645119 1516941.625 2423872.25 3638140.75 3116280.25 767817 904657.625 1784371.125 518247.4375 1918235.375 1744888.875 4390001.5 3797704.25 2626341.75 4325005 1312311.75 2921916.25 599875.625 4047657.25 4280987 3430569.5 6054323.5 6087296.5 5397460 9063131 1827656.75 2574568 12271355 1249159.25 854557.4375 1995615.125 962782.5 5221761.5 1240698.625 2104108.5 6319989.5 1943959.5 6610725 2329124.25 2583594.75 2469385.5 4779517.5 3346280.5 5870596.5 4578067 520828.3125 2432748.25 2125890 720175.75 465131.6563 532730.1875 712686.3125 724528.5 1202153.125 4368654 3046334 145498 0 0 0 271724 0 0 0 0 225260 0 140662 120062 0 109907 121464 0 515600 124088 0 0 542863 358421 581059 66726 826069 96036 221155 242007 269775 340439 151926 0 0 353056 88481 921007 193997 163754 160135 239491 46763 0 383360 222858 105695 155984 157644 0 0 58788 0 675983 956757 223217 0 396562 120744 1005246 261803 171555 221322 0 228432 0 1071875 0 76894 104076 118794 142821 221488 0 0 176030 123810 142245 87773 361464 0 821341 926961 612080 633175 245068 0 0 141378 92638 280667 287382 160686 0 72019 54403 547716 114041 221322 763898 597776 2-hydroxyglutarate 4471953 5990586.5 5515421 27292200 12076506 5049600.5 7566320 4713408.5 6456032.5 10240207 5542099 7149788 7332038 7381193.5 10029087 8467645 7754117 5757862 8169462 3657253.25 7748310 8103493 3777840 7208533 9894038 6061545 16312154 13465956 5826766 15693460 23804756 23434214 6425245.5 5270017.5 6740374 6213642 8291694 4734399.5 11502934 7754117 7759924 8677545 4882636.5 4568845.5 5717116.5 24203320 15024824 19880042 30057620 9227563 8908573 3304007 15292097 17207184 8567016 17847390 7913840.5 40678928 6464377 12191325 4877586 4868554.5 12973482 12540766 4422083.5 12088272 6184454.5 15550109 12931566 5985966.5 3237995.25 5435093 18866088 6568317.5 6322100 17862324 4479053.5 3150316.75 4345335 2287631 6650931 12938604 7811077 8209894.5 7461830 1581599.375 7543591.5 5830196 26626412 20965624 13697556 28172482 23726442 22992302 7235405 14398530 1249096 3351235 5934518 2641036 6486748 1140063 3238873 706937 781704 2212001 76926 2726413 9319328 2739252 1487666 1826725 280525 1724539 3078369 407118 1126834 635940 826607 1683922 362785 1340488 2992176 1170792 11911713 1088673 1574906 1404666 1625726 2295753 789324 2198070 2504636 3311245 1828752 639214 1034931 3761794 2918032 925433 8187311 3525254 1827738 2249498 933743 2045477 865296 2281214 1555041 471452 561200 2264085 2813236 1331641 1952709 998313 3391897 2872394 2930440 24111 134954 1858535 7562596 2030022 1745282 2064663 1940114 1827738 263760 221907 7528901 1119743 4098423 4039842 1660516 254675 648741 1479586 2484486 1113277 2255689 97239 104987 145648 82919 5769275 2768205 5346619 2981150 1566684 3012902 3476461 14055780 726186 3831149 3144137 2-pyrrolidinone 10582584 11838807 4997270.5 22174988 15710461 18768758 12798830 4506911.5 5995883 5936379 3368733 3497722.75 11959918 12237624 4836193.5 5621612.5 4386365 2803177.25 4329373 3341868.5 15220922 8086619.5 5459276 3451627 3118780.25 1823160.625 3894454.25 14920715 4943485.5 54523364 25481538 5306772 7159158.5 3660480.25 7019054.5 5306772 4257986 8418461 3648344.75 4414830 4561298 4641596.5 34128828 5923426.5 34307288 4972765 105256024 46455816 6584714.5 5642551 5772741 4303143.5 10373738 3761986 5898263.5 9282952 12632430 4402178 3800478 4648203 0 2279519.25 2672627.25 4497325.5 1662020.125 1829858.75 4545268 5394564 5925642.5 4213771.5 3914108.5 6011010 1809557.75 7914972.5 8024564.5 1352262.75 1429747.5 0 2814018 3025371.5 4840803 1424477 3535593.25 3963212.25 4923844.5 1190423 6128952 2826020.5 13242468 14650385 8184534 14357801 8984458 19710148 30703220 8046565 1129062 1954673 863416 1881284 2746283 6125502 782303 352202 1823621 2312427 518215 2754964 1219670 1886336 2276477 1399293 405494 1897485 4771730 4469544 592460 858545 431848 1555565 1094305 2196822 4063203 4279697 1631266 1684519 960726 2464335 1945130 3015710 1734640 2562974 1158842 2826262 2764013 1608686 654449 7365708 6918976 1491381 2870556 3859669 4332978 1336234 779264 3343352 1906949 2857550 6970460 10892870 6202553 1821618 2830188 632957 814005 1586778 1945130 1283584 1502175 11647861 961856 900323 829848 3263519 2031109 2335465 2797986 16742027 544384 768155 1368596 2064798 1529480 1715880 2568798 952636 1993781 2343197 1304074 1067972 4337766 3217069 2923936 26150074 12611327 1825462 2431415 1776726 2066935 2190582 1014541 2334503 9754104 1241593 6691671 2091327 2,3-butanediol 9713334 13182439 31881378 60535928 36115300 71651048 94505720 23686604 25142594 26856800 41680112 39728764 26332336 20952262 48184324 14275411 19339316 70329032 46995472 44401272 37539396 37782992 10079884 73951560 69653992 25077358 33430470 33357402 5959431 4888334.5 1929291.5 1984365.25 28174860 19620700 15190096 25225616 40038388 15257184 20372970 21412424 26613152 20924528 23166544 24771816 18532882 5585665.5 17456638 16849642 4471916 40304344 26613152 39080084 22025802 36101568 47211412 83769144 98604656 5958985 14770641 25497748 71910704 47100480 47737100 48432272 60662288 13991528 23364854 0 24652372 15886713 26613152 20402046 47464284 32268770 47469344 21453402 48501276 33297830 37986172 36604148 28299290 59955924 44196972 37182384 38903908 18094554 17738704 44080652 10012592 3243522.75 3276723 3987094.75 3923794.75 16772570 55548420 147662720 3997746 4588067 11616405 364061 11806366 8118381 1377535 0 7944326 2015640 0 2576911 73409800 1352195 5382833 3659694 1402254 9267612 8398938 13753227 7774399 11393961 3146173 3974305 1023786 5145916 1569359 5780665 104976760 6895025 5096129 11209688 922869 1168104 4390802 3505091 7530014 8391196 10863524 4370307 7056437 1079086 5654522 3478365 856646 589941 6060308 12992086 1595616 11733902 1279887 897734 12660662 6258168 1904387328 848277 3103168 4898863 4313798 5350901 1487013 3091320 1292085 11000783 104187 6899412 26086744 2639055 2389502 1540557 8447830 11979058 49394 0 98369592 7175443 1316245 1277821 3391750 128722 81915056 3028578 9746256 8288597 9804186 172379 248069 11104361 27525538 2860338 7060496 4743465 1520570 1968576 485251 4964720 2061398 5130550 6170484 10144677 2,3-dihydroxyisovalerate 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 11175715 11175715 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 563783 27512 0 0 0 0 0 0 0 125928 0 1456058 0 0 0 0 0 0 0 62105 0 0 76702 0 0 0 0 2090276 0 0 0 0 0 0 0 0 0 0 0 127740 0 0 0 0 0 0 0 0 61341 0 0 29107 0 574181 0 0 0 0 0 0 0 0 0 0 0 172339 0 0 0 0 0 0 0 2892052 0 0 0 0 0 282573 0 0 0 172339 0 0 0 0 0 0 0 0 0 0 0 198459 0 0 0 3-deoxyglucosone 13488123 7551114.5 9226053 25626122 24049322 22469510 17782834 49710232 21042578 36907888 66319408 36050104 28721972 16959974 37822912 24045310 41782376 29240062 14682520 37089124 108683576 43991116 70403736 117497104 45121840 72085312 27859352 28235222 6584027 41201372 7198432.5 11650580 60688612 50527176 29474222 94677016 53902836 28493286 50788396 26742736 17372664 20046370 31317756 23859900 12480463 1701659 17449240 9958661 10044130 19731734 13972464 66737324 36239104 28425162 29111984 5642775.5 3854034.25 4459353 34049460 14852251 79865016 62366504 24031770 14208904 91828088 33552936 38237632 45715572 15381095 22176388 21388058 7588877 55342536 2039795.625 2124448.75 101506968 26742736 30906486 48384872 40475256 34980992 42466148 30508378 30932756 10095097 6095304 20361204 82612000 13728011 3680359.75 3284341.25 4334471 1320756.625 1443190.875 7863142 4218880.5 206747 132428 0 263740 969726 1062543 84559 0 2437903 801922 0 216572 498528 7411124 908200 0 0 553763 195636 81447 1293715 11851493 5425191 2940811 0 19935032 971015 1034818 0 1279602 5696760 182049 2700091 0 225647 156349 11225094 234049 422525 15779050 13740656 267630 252562 2905812 2218628 0 0 174772 15177506 0 489204 263975 644262 8645812 221869 14387085 241545 0 10773981 8296634 17817278 8058141 324146 0 0 23787626 0 109661 1611957 558051 249601 801922 0 0 257410 250938 400724 571888 801922 0 377470 4288600 26305664 6649042 390583 0 0 0 0 2556063 1571733 3530427 0 131227 157885 347018 573637 1607209 918564 331996 3-deoxyoctulosonate 3769692 2672779.5 1606613.25 1595122 2041561.125 990387.125 1490788.5 3172190.75 3364284.5 1997443.625 1275115.25 1372818.75 1198857.5 1082206.25 2468607 2140923.75 3219378.5 2590774.5 1653930.625 2075848.25 894782.4375 1103286.625 1053683 1857417.875 1052824 1977394.75 1962828.5 3229123 6821298.5 2309993.75 1717378.375 727835.125 1965181.625 2297260.75 1447219.25 1542651 2521165.25 1243983.25 3146100.75 2525047.5 1530508.375 1700530.125 5143917.5 2165612.5 3433219.75 2189582.5 1889559.125 2577947 2573585.25 1923100.625 2264965.75 1296243.125 2145372.75 2416970 2882034.25 2152931 1920513.125 1647653.875 1984887 2345316 2829643 1761956.375 3101575.25 1858811.75 1085116.875 2986041 1793175.375 1618829.625 2710661 1437437.625 3367464.25 3135011 2701498.75 951402.3125 2415310.75 2276508.25 2277186.25 2095305 2239249.75 2589934 2527762.5 2562282.25 1665266.25 1316600.375 2095305 1582563.875 2033820 2049686.625 1956017.875 4288464 3911917 3814675.75 2544073.25 3278559 1597715.625 4494710 489723 645103 785024 792241 672428 572131 637517 444184 668054 682485 780062 506178 714641 409546 412082 719650 1164987 546488 586548 1147004 958755 820158 389253 657824 1346534 502745 403233 663159 1063372 320394 335108 451615 792647 536513 1300512 403550 319010 822139 567862 213871 341631 576697 596404 619158 418707 1313081 569031 516738 278216 707590 329882 428635 746961 334594 909133 337782 480801 791513 409530 549140 418131 2299688 518893 598767 1497656 387368 851055 515708 489808 3184150 721540 574347 1669237 967834 527870 571997 785771 440397 820549 545080 416442 475183 917474 574347 469202 998743 734155 534251 929563 1215964 942519 1182026 438846 544692 832701 546766 1052655 502725 528320 515547 3-hydroxybutyrate (BHBA) 4840693.5 2732044.75 1101188.625 2116377.25 1864728.25 1734961.375 1592732.25 805871 1950005.75 2212898 2655969.5 3269599.5 2532396.25 954321.875 1247517.5 1613923.25 1459093.625 1225482.125 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836019 599629 174424 524611 179502 824670 282192 496123 698050 187198 235233 622041 152235 298138 657558 966743 549655 184309 466606 232633 473828 285825 408860 409348 1153580 689244 356902 153603 623057 141294 644417 466416 98215 464128 264852 498588 743273 142654 324416 288926 212723 3180387 74966 109908 521545 149372 210634 411496 279714 90565 626165 500936 248532 660026 168483 135474 133243 272021 560809 298995 182881 229393 138413 93811 236287 256037 262601 229263 319896 337680 3-hydroxypropanoate 5070780.5 3208017 4280067 8406357 7511451.5 5127703 3739831 9151636 7362067.5 9887433 17283074 8697826 5437143.5 6215759 7174851 6170637.5 6631993 5527738 4173939 6215759 13496677 7083183.5 16265330 16286509 10403375 13886858 6260880.5 5501649.5 2608418 12764619 4122905 3586007.25 14592504 2537900.5 4732878 11534945 8294484 14366251 18063256 20237324 9492773 6660079.5 14347951 20027904 18431384 2940734.75 4561691 5598562 2706306 2878456.75 2677452.25 8996600 6702336.5 5134254.5 6579323.5 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1575558144 746273920 1727328640 990941312 1216790912 2042367104 2011022976 1603139712 2077859712 790554816 2058754048 1549278976 1773740544 1931986816 1603492480 1465858944 1346285440 1789683328 1933463936 1098607104 715547968 2032995072 1855230208 1661165440 1106083584 1902187264 2013876864 1621974272 1950884864 1498895488 1796304000 1697931264 1094094848 1758188544 1658750464 1617577344 1631662208 1936733952 1693568256 1396156032 2138264320 1592664192 1838113024 1738172672 442802400 1940334464 1997936000 1418395776 1077202432 305627392 2288922112 1442980096 1586709376 1781339392 1617577344 1598549376 1831782656 567055168 670890816 1486150912 1742605952 2257343488 1592252800 2141353088 1180760960 1500865792 1751154304 2003286784 1793156096 1213605120 627845888 816721536 1313734272 2122018816 1726088320 1715914624 1926530688 1638378112 1610833536 1515448960 1611798144 1727627136 1377169280 2057279488 1593233536 glucose-6-phosphate (G6P) 7562117.5 12188398 7642623.5 7438102 8422914 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41575276 3268725 180534304 36225844 57892040 29446706 35252976 7794757 7994109 24733328 36475364 38957052 31367218 53968892 45421196 30990228 24009206 36431840 64686796 42865920 38998476 38502584 glycine 34333156 50523344 21978510 18704304 27811292 13192403 38762600 31863468 48234764 31355998 5143984 10553804 60610776 65170756 26014802 45143264 34733452 15301024 18200590 7997281 3286467.25 11558961 13466962 8952547 8629573 1406761.5 21322890 25924312 51522944 11675210 20013598 10263261 16933038 33557924 18333678 9660751 12498221 17538380 9806765 16196252 6927063.5 17337204 16059630 32786644 24562518 38990244 56635216 42502732 43593256 13932390 44215132 3444640.75 20013598 10413671 28469956 38864964 28405346 87742360 13594120 18823486 4879796.5 3757104.5 32653512 30877552 1642029 23330728 31566326 35644888 28342752 26115282 12705000 16160058 7974033 40027452 43280420 2499021.75 6104679 2270696.5 6523895.5 11083744 9385764 9760583 14693068 14244603 31719478 4714388.5 23656458 4222529.5 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19609152 17318254 14877024 25364428 25863374 27665562 20525414 15961747 18923720 29072742 18171080 32989990 22640858 23589664 22372872 20018338 20273734 15409878 14268537 11516608 17247562 33385498 13925008 16265866 25071528 21310542 33579896 38344824 48820848 18424028 20007112 28797406 36409888 44930792 8993139 25399574 24985464 14776632 13354422 12505589 19178088 24105402 13332205 21355582 19111490 14149279 14101213 22890252 18242958 19244688 18015660 19108642 20836832 33770732 33112396 35034176 14351955 14339418 14830900 21709958 16676808 24444568 5722632.5 7809659 30130180 14922026 29347708 26980606 19178088 32208758 26130494 20414834 17946756 12718634 7646871 18807912 17785270 14462929 12745197 11037057 12524494 8277883.5 8309372 15153720 9266629 1433901 1130935 1197192 1491455 2411661 3468902 1260780 570302 2519605 1777133 703882 1268077 1116860 3217159 1685096 1380783 980217 1985009 1024500 5838711 3863121 7662423 5195767 1723243 1310278 5855693 1466202 1399445 1390728 1565505 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258680.7031 311939.5313 603031.9375 227673.5469 130650.9844 357109.125 498533.9063 330128.7188 303076.1563 243254.7969 373606.0313 371519.3125 469919.8125 123094.4219 266141.1563 251804.2969 217488.5781 464456.8438 270781.2188 358622.9688 513987.6875 371847.3438 147664.6875 234597.0469 279808.6875 249865.2344 0 102548.3359 133029.2813 111364.9844 464358.625 0 85538.4297 361068.4063 230946.0938 396045.0938 316465.125 223150.3125 63843.1367 150052.2813 107052.0391 248164.6875 399639.3438 82684.0156 241977.625 317165.6875 194144.0938 151202.0938 189251.125 159357.0781 249984.5 168451.0781 400595.125 270703.75 192032.5781 186725.8125 182993.2344 243471.6406 67892.0313 201415.6875 279310.25 108701.8828 353210.8125 346468.6563 450335.4375 300991.8125 254762.1094 218022.5625 249343.9063 131671.5938 272625.9688 187461.7344 285340.875 541767.8125 260453.5313 273989.7813 249984.5 295371.5625 204708.125 296117.2813 234582.0781 333003.1563 223025.7188 429844.5938 423753 92736.1953 121151.6719 0 0 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19820340 20567926 14737165 15579596 3826823.75 5945958.5 51416764 7967717 6980249.5 6235742.5 4659196.5 10860059 16433019 14482230 8694379 11734963 9804826 10866656 8733009 5461011 10050686 9976679 9117829 10872933 10321972 5139399.5 10657726 5528297.5 3583656.5 2270173.25 3978673 3373553.75 8802544 12438969 41180064 1538497 2248523 1738681 506901 1632819 1554158 506118 122264 2485791 5263343 68581 1177284 6500149 845839 1641535 804188 131291 3608998 1508661 1174015 1405552 1406253 1390508 1723433 210687 1311236 1260576 1611724 16212419 1500175 1089455 1668718 388400 875202 958914 691942 2030963 2897342 2349942 657391 1125859 1139117 1734858 842122 631448 986231 1526517 2810906 1278744 2171437 659753 360117 3589107 1439147 3936490 883302 1687566 1357727 1818951 1517413 929920 840129 1015454 1541011 133016 2402980 1684440 878480 914234 896131 2100256 2067425 0 0 4928878 1341869 879620 686544 1293772 56852 9106410 1231919 2507113 1343314 3688623 265360 147633 899329 1119982 934295 1529633 2117016 1390508 1587625 274479 3135914 1931301 1391186 4614373 4259395 trizma acetate NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL NULL 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3294951 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 xylitol 2774198.25 1402236.125 2245516 7318586 5447988.5 4580436 6927539.5 5168679 7104567 3553304.5 8247958 3688477.5 5161421.5 4699577.5 9148335 970091.5625 2612528.25 6805606.5 4299839.5 6025984.5 5180822 6919394.5 2281732.75 7950165 8089981 4851077.5 1984409.25 5937840.5 6516295.5 1994742.125 3728850.25 2455571.5 7251214.5 3964333.75 3554308.25 3135430 3314868.5 4005026.5 5792357 2746678 3817083.5 4699577.5 3018112 2844346.5 3210312.75 1829380.625 6136215.5 13688867 2111886.75 2489938.75 1716783.625 3740526.75 5083050.5 3600791 3176581.25 3655625.5 4046799.25 6034857.5 4860283 3195372.5 4603801 6605416 3974341 3706706.75 8234952.5 1247496 3684293 9799846 6617213.5 5492105 13472556 7420195 6490384 9661364 6677527.5 3939022.5 4519999 7453591.5 4766688.5 4838118.5 4629254.5 3399187 6079871 4148250.5 3254968.5 11077164 3330324 4795354 6251302 7490711.5 3081781.75 11278635 5934035 8199227.5 5506506 15374397 828251 779805 2835807 707204 1363654 1505939 556622 351286 1320986 1941011 214913 1225889 1343477 1504721 759338 1101017 576662 2059899 1110623 2796249 2021914 1498296 634506 953838 3228277 678377 1164349 1478987 1842985 619890 1225889 1822794 753128 1568833 3963179 851483 1442641 1164166 1722253 675729 986075 2614729 836784 424637 1234056 1887793 1710198 1097916 1473428 1945583 1511793 1789403 2412535 751197 9637028 2820054 1164965 4764997 1058197 1347632 1663086 819541 1500826 5845091 47816 943032 2124635 445816 517017 420178 1063966 779286 82231 186189 4443563 1084792 741081 555401 945428 485865 5836467 1186319 1159815 971357 2423894 152890 241378 4972619 8481963 836959 1565932 1799303 1428799 1071714 322860 2416200 1604349 1293353 1764761 1286813 xylonate 26201840 26550260 8524556 10660571 7227698.5 20143716 26968352 15553632 20167958 17188884 20244098 17542714 30426522 20742630 12950485 12677067 16442393 10350766 10774880 0 18587536 16959326 14831635 18172040 16950378 14317802 15523608 15846086 12315123 9235753 5165358.5 4388343 20000860 13983616 17009732 26361090 5904163.5 13903309 26748728 26679398 12132398 10054220 9592844 14312330 12540490 7683521 11003741 6048382 15331665 26190218 18069268 17315226 18364050 12126722 15846086 35658256 31366206 6423744 16272598 15979933 16168563 0 32371498 13261167 17230154 11170419 23904424 11782802 19404450 30208154 23507662 22362660 11167410 16228274 28543122 17219760 14048109 22717422 15623512 12247402 25871970 12127613 10563859 11696335 34862700 13400553 9924089 22511434 16269154 5170363 7262446 6958291.5 12361070 19339398 7808161 27781330 2183452 3055473 2485177 1866955 2770176 1170260 1572085 923478 2756715 1725820 751977 2168497 2076705 2586744 3148899 1309813 1637596 2497313 7427616 3880952 1545130 5219245 2759888 2254600 1763271 4075929 2400612 3267750 3523702 3163876 2665074 1533480 5507969 1181964 2806652 3663192 5128764 2351830 1396441 3962656 3655489 4646986 1569429 1890454 3009209 3710424 1976214 2196079 1371393 2196153 2231847 1181094 2416099 4059267 2084989 2809755 2253416 1934996 1222873 4103358 2196153 4258706 1102239 1314081 2150461 3597799 2166719 1656245 2886102 2773914 2023643 4290520 2664860 1932347 1576162 2412515 972057 1958473 4903438 771890 2044477 1881014 5659578 4161960 1599961 1069475 856374 1037413 1385429 5469217 3132249 2564386 1323379 1393806 1965082 1850150 2138890 2146534 2202893 2947751 xylose 14035172 0 38454572 65101192 55477092 53277784 47884636 25271682 58274388 37763736 51701636 34032896 60676880 40135564 65517984 26369308 35298680 51685396 30571226 74377280 55250576 48808396 18245274 38073864 38002012 31695650 39564072 58661964 0 4485840.5 3687948.25 5889844 63311540 19195558 12585221 37556936 20664368 34427084 37910728 32704674 15078901 8207979.5 5843926.5 38034856 29076900 12726162 57213680 70903064 17147462 23212620 11673333 21837188 34665792 30069588 65617636 22949472 54430492 8967172 34665792 54513576 19122984 48746856 41108996 25853628 41441260 24117194 48015016 29563712 23930594 22354274 61992188 10443088 38754012 38015172 22512606 18547120 23793338 44623156 40358832 29940424 45746464 45985740 49221436 51410792 36418536 131242448 40956460 14722610 6704377.5 6268861 8262235 8993494 10098287 10431067 42783232 26621006 11413800 14733037 13706025 1470042 3780492 9940065 3733690 691699 12004609 23377650 592888 13261342 13114538 711441 9953525 13491421 2355467 11878603 6662723 20231050 10391990 8154016 7763951 15654861 3087141 7984439 2378471 4988951 18262238 7254757 4683792 20432748 2950983 0 17115490 3128268 7535263 11024992 25471640 3155267 6075579 6650476 10260351 8099716 2123354 1995161 5547638 10326234 2145281 14385521 1531920 1140973 19098950 8717180 22053038 4138690 3922081 22448870 2642375 9624252 1597378 6381655 13720452 36386420 1239137 8214993 9915855 6098282 7561061 6197551 14320330 6018507 1054135 1691663 22889338 15152455 2975188 3887171 8413283 941608 12870700 11306994 11888892 6677219 39740740 1187117 1061356 14835782 50457948 7705087 5937539 11653987 17546966 15256630 2398716 17682052 6583859 17010086 22473398 8494345 xylulose 1459967.625 1014552.9375 4388226 7932723 7581708 2377302.5 2498312.5 5248782 5498778 6407879.5 12018961 5544834 4904084 3379544 4161629.25 0 0 6890710.5 3398627 6292303 8353639 5636619 7399521 3872777 3442074.75 6511180.5 4060538 4338322.5 612754.1875 1323988.75 536138.5 1241261.25 7041407 1626248 1317251.625 4461571.5 2234497.25 3834163 11301095 4078434.25 3655031 3140117.75 2609702.25 6857109 2262850.5 530682.875 3197333 4173240.5 1525823.75 1430778.625 1474186 3086617 3495586.25 2516015.5 4086279 2188631.75 3464484.25 288937.3125 4712974 2085185.75 3233080.5 2731512.25 2853330.5 2566436.5 9912949 2460785 4666331 2387919.75 1827695.875 1441192.875 5187893.5 832964.6875 6363981.5 1365205 539293.0625 5663176 1626874.75 4714027.5 2760044.75 2700610.25 4757553 6716864 3275927 4838930 2964296 3845079.75 3233080.5 2073288.875 1712509.625 456501.7813 267848.375 501991.1875 529049.0625 396092.2813 4266501.5 869770.3125 389650 586801 789279 257399 0 511373 189381 38429 323951 858879 0 552964 493446 333946 461953 438892 96137 563598 166012 662051 800541 1742475 743715 773687 272439 950011 281955 755264 1144964 327581 523568 691283 174537 903264 622158 205379 541496 586912 1133457 339956 1130018 1254199 324122 301255 95009 0 359855 620282 230756 546760 129452 121971 2756522 794058 4341556 406552 665835 1042513 241868 466974 513427 553033 397864 1201168 0 1120087 1067438 208578 350833 181849 435020 220460 0 0 1385847 494104 190896 122986 365570 0 6220154 815823 784310 601394 1725449 27947 35001 1168529 2823535 485428 641316 310044 577653 632425 130749 1646267 354046 535764 1509874 439216 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name retention index quantified m/z PubChem ID KEGG ID 1-kestose 2376.9 361.1 440080 C03661 1-palmitoylglycerol (1-monopalmitin) 2119.5 371.3 14900 1,2-propanediol 1041 117 1030 C00583 1,3-dihydroxyacetone 1263 103 670 C00184 2-aminobutyrate 1215.7 130 439691 C02261 2-hydroxybutyrate (AHB) 1169.4 131 440864 C05984 2-hydroxyglutarate 1576 247 43 C02630 2-pyrrolidinone 1190.9 142 12025 2,3-butanediol 1075 116.9 262 C03044 2,3-dihydroxyisovalerate 1422 131 677 C04039 3-deoxyglucosone 1579.3 129 159630 3-deoxyoctulosonate 1942 373.2 4636210 3-hydroxybutyrate (BHBA) 1203.5 116.9 441 C01089 3-hydroxypropanoate 1187.1 177.1 68152 C01013 3-hydroxypyridine 1187.1 152 7971 4-hydroxy catechol 1599 342.2 10787 C02814 4-hydroxybutyrate (GHB) 1277 233.1 10413 C00989 acetoacetate 1285 231.1 96 C00164 acetylphosphate 1263 211 186 C00227 alanine 1147.6 115.9 5950 C00041 alpha-tocopherol 2305.4 502.5 14985 C02477 arabinose 1631.6 217 66308 C00216 arabitol 1687.5 307.1 94154 C01904 arabonate 1736 292.1 122045 C00878 ascorbate (Vitamin C) 1850.1 332.1 C00072 asparagine 1651.2 231 6267 C00152 beta-alanine 1451.8 174 239 C00099 beta-hydroxypyruvate 1425.1 221 964 C00168 beta-sitosterol 2380.8 357.4 222284 C01753 campesterol 2353 343.4 173183 C01789 citramalate 1490.7 247 1081 C00815 cyano-alanine 1402 140.9 13538 C02512 digalacturonic acid 2220.9 375.2 6857565 C02273 erythritol 1517.5 217 222285 C00503 erythronate* 1546.9 292.1 2781043 erythronic gamma-lactone 1450 247.1 5325915 erythrose 1431.1 217.1 94176 C01796 erythrulose 1496 205.1 5460032 C02045 ethanolamine 1304 174.1 700 C00189 ethyl linoleate 1963 262.29 5282184 D01590 fructose 1831 305.1 5984 C00095 fructose 1-phosphate 1983.1 445.2 65246 C01094 fructose-6-phosphate 1994.9 315.1 69507 C05345 fucose 1682.2 204 19466 C01018 fumarate 1382.1 245 C00122 galactinol 2226.1 433.3 439451 C01235 gamma-tocopherol 2264 223.1 14986 C02483 gluconate 1879.4 333 10690 C00257 glucono-1,5-lactone 1838 275.1 7027 C00198 glucosaminate 1900 291.1 73563 C03752 glucosamine 1851 203 441477 C00329 glucose 1780.9 217 79025 C00031 glucose-6-phosphate (G6P) 2042.7 387.2 5958 C00668 glycerate 1360.7 189 752 C00258 glycerol 1311 205 753 C00116 glycine 1166 101.9 750 C00037 glycolate (hydroxyacetate) 1119 177 757 C00160 homoserine 1471 218.1 12647 C00263 inositol 1-phosphate (I1P) 2057.8 318.1 440194 C04006 inositol 2-phosphate (I2P) 2072.9 318.1 C01177 isomaltose 2221.8 204.1 439193 C00252 lactate 1102.8 116.9 612 C00186 lyxose 1603.5 204.1 C00476 malate 1502 233 525 C00149 maltulose 2157 361.19 44630390 C19633 mannitol 1839 319.1 6251 C00392 melezitose 2403 361.1 92817 C08243 methylphosphate 1221 240.9 13130 myo-inositol 1924.9 217 892 C00137 palatinitol 2233 204 3034828 phosphate 1307.7 298.9 1061 C00009 putrescine 1705.8 174 1045 C00134 pyromucic acid 1181.2 125 6919 C01546 pyruvate 1130.6 217 1060 C00022 ribitol 1692.4 217 6912 C00474 ribonate 1663.1 246.1 5460677 ribose 1639.2 204 5779 C00121 ribulose 1662 306.1 151261 C00309 S-methylcysteine 1447.8 162.1 24417 serine 1389.1 204 5951 C00065 sinapyl alcohol 1923 354.1 5280507 C02325 sorbitol 1843 319.1 107428 C00794 succinate 1348 247 1110 C00042 sucrose 2136.1 361.1 5988 C00089 threitol 1513 217.1 169019 C16884 threonate 1560.7 292.1 151152 C01620 thymine 1429.1 255 1135 C00178 trihydroxybutane 1329.5 117 20497 trizma acetate 1525 306.2 6503 C07182 xylitol 1677.6 307.2 6912 C00379 xylonate 1722 292 6602431 C05411 xylose 1723.9 204 135191 C00181 xylulose 1668 306.1 5289590 C00310 METABOLITES_END #END