#METABOLOMICS WORKBENCH adinda_OU_20220307_230531_mwtab.txt DATATRACK_ID:3116 STUDY_ID:ST002144 ANALYSIS_ID:AN003510 PROJECT_ID:PR001358
VERSION             	1
CREATED_ON             	March 7, 2022, 11:10 pm
#PROJECT
PR:PROJECT_TITLE                 	Structure-based non-targeted mass spectrometry imaging analysis of dried long
PR:PROJECT_TITLE                 	pepper
PR:PROJECT_TYPE                  	Non-targeted mass spectrometry imaging of dried long pepper
PR:PROJECT_SUMMARY               	The attached MSI datasets of dried long pepper sections were analyzed in the
PR:PROJECT_SUMMARY               	manuscript by Wisman et al. Below is taken from the abstract: Many studies have
PR:PROJECT_SUMMARY               	applied multivariate analysis to mass spectrometry imaging (MSI) data to
PR:PROJECT_SUMMARY               	differentiate structures in a sample based on information of compound spatial
PR:PROJECT_SUMMARY               	distribution. However, the actual distribution of individual compounds remains
PR:PROJECT_SUMMARY               	poorly documented, especially in plant samples. Here, a detailed non-targeted
PR:PROJECT_SUMMARY               	approach for plant sample analysis applied for the study of compound
PR:PROJECT_SUMMARY               	distribution in the medicinal species, long pepper, which has complicated
PR:PROJECT_SUMMARY               	internal structure. Principal component analysis (PCA) discriminated between the
PR:PROJECT_SUMMARY               	seed and pericarp regions, resulting in peaks that were closely associated with
PR:PROJECT_SUMMARY               	each region. Investigation of these peaks revealed slight but potentially
PR:PROJECT_SUMMARY               	important distribution differences between them, despite sharing the same
PR:PROJECT_SUMMARY               	accumulation profile in a region. Furthermore, piperamides such as piperine and
PR:PROJECT_SUMMARY               	piperlonguminine were among the compounds closely associated with the pericarp
PR:PROJECT_SUMMARY               	region. This is the first study to report the utilization of PCA for spatial
PR:PROJECT_SUMMARY               	feature extraction and the localization of piperamides in dried long pepper.
PR:INSTITUTE                     	Osaka University
PR:DEPARTMENT                    	Biotechnology
PR:LABORATORY                    	Bioresource Engineering
PR:LAST_NAME                     	Shimma
PR:FIRST_NAME                    	Shuichi
PR:ADDRESS                       	Yamadaoka 2-1, Suita, Osaka, Japan
PR:EMAIL                         	sshimma@bio.eng.osaka-u.ac.jp
PR:PHONE                         	+8106-6879-4170
#STUDY
ST:STUDY_TITLE                   	Structure-based non-targeted mass spectrometry imaging analysis of dried long
ST:STUDY_TITLE                   	pepper
ST:STUDY_SUMMARY                 	The dried long pepper was analyzed by MALDI-MSI IT-TOF. Please refer to the
ST:STUDY_SUMMARY                 	manuscript by Wisman et al. for detailed information.
ST:INSTITUTE                     	Osaka University
ST:DEPARTMENT                    	Biotechnology
ST:LABORATORY                    	Bioresource Engineering
ST:LAST_NAME                     	Shimma
ST:FIRST_NAME                    	Shuichi
ST:ADDRESS                       	Yamadaoka 2-1, Suita, Osaka, Japan
ST:EMAIL                         	sshimma@bio.eng.osaka-u.ac.jp
ST:PHONE                         	+8106-6879-4170
#SUBJECT
SU:SUBJECT_TYPE                  	Plant
SU:SUBJECT_SPECIES               	Piper longum
SU:TAXONOMY_ID                   	49511
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
SUBJECT_SAMPLE_FACTORS           	-	LP010	Analysis Type:Non-targeted	Sample Type=Long pepper; RAW_FILE_NAME=LP010_scan.zip
SUBJECT_SAMPLE_FACTORS           	-	M01	Analysis Type:Non-targeted	Sample Type=Matrix; RAW_FILE_NAME=M01_scan.zip
SUBJECT_SAMPLE_FACTORS           	-	LP011	Analysis Type:MS/MS	Sample Type=Long pepper; RAW_FILE_NAME=MSMS_274.zip
SUBJECT_SAMPLE_FACTORS           	-	LP012	Analysis Type:MS/MS	Sample Type=Long pepper; RAW_FILE_NAME=MSMS_286.zip
SUBJECT_SAMPLE_FACTORS           	-	LP013	Analysis Type:MS/MS	Sample Type=Long pepper; RAW_FILE_NAME=MSMS_340.zip
#COLLECTION
CO:COLLECTION_SUMMARY            	As stated in the manuscript: Dried fruits of P. longum were obtained from S&B
CO:COLLECTION_SUMMARY            	Foods and kept in a dry container at around 25 °C.
CO:SAMPLE_TYPE                   	Dried long pepper
CO:STORAGE_CONDITIONS            	Room temperature
#TREATMENT
TR:TREATMENT_SUMMARY             	N/A
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	As stated in the manuscript: A dried long pepper was appropriately cut to small
SP:SAMPLEPREP_SUMMARY            	pieces before embedding horizontally in 4% carboxymethyl cellulose and freezing
SP:SAMPLEPREP_SUMMARY            	at −80 °C. The frozen block was then attached to a sample holder with an
SP:SAMPLEPREP_SUMMARY            	optimal cutting temperature compound for sectioning inside a cryostat at −20
SP:SAMPLEPREP_SUMMARY            	°C. Longitudinal sections 20 µm thick were collected using an adhesive
SP:SAMPLEPREP_SUMMARY            	cryofilm (type II C(10), SECTION-LAB, Hiroshima, Japan). The collected sections
SP:SAMPLEPREP_SUMMARY            	were attached using conductive double-sided tape on an indium tin oxide (ITO)
SP:SAMPLEPREP_SUMMARY            	glass-slide. The CHCA matrix was deposited at a thickness of 0.7 μm using a
SP:SAMPLEPREP_SUMMARY            	vacuum deposition system (iMLayer; Shimadzu, Kyoto, Japan). Recrystallization
SP:SAMPLEPREP_SUMMARY            	was performed by exposing the matrix-coated section to 5% methanol vapor at 60
SP:SAMPLEPREP_SUMMARY            	°C, for 30 s.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	Other
CH:INSTRUMENT_NAME               	none
CH:COLUMN_NAME                   	none
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Shimadzu iMScope TRIO
MS:INSTRUMENT_TYPE               	MALDI IT-TOF
MS:MS_TYPE                       	MALDI
MS:ION_MODE                      	POSITIVE
MS:MS_COMMENTS                   	Shimadzu IMAGEREVEAL software
MS:COLLISION_ENERGY              	70
MS:MATRIX                        	CHCA
MS:MS_RESULTS_FILE               	ST002144_AN003510_Results.txt	UNITS:Da	Has m/z:Yes	Has RT:No	RT units:No RT data
#END