#METABOLOMICS WORKBENCH mhandzlik_20221111_122734 DATATRACK_ID:3569 STUDY_ID:ST002344 ANALYSIS_ID:AN003828 PROJECT_ID:PR001502 VERSION 1 CREATED_ON November 14, 2022, 8:59 am #PROJECT PR:PROJECT_TITLE Serine and lipid metabolism PR:PROJECT_SUMMARY We analyzed hepatic sphingolipids in mice (C57BL/6J) in response to 8 dietary PR:PROJECT_SUMMARY interventions: 1. Low fat diet + vehicle 2. Low fat diet + myriocin 3. PR:PROJECT_SUMMARY Serine/glycine-free low fat diet + vehicle 4. Serine/glycine-free low fat diet + PR:PROJECT_SUMMARY myriocin 5. High fat diet + vehicle 6. LHigh fat diet + myriocin 7. PR:PROJECT_SUMMARY Serine/glycine-free high fat diet + vehicle 8. Serine/glycine-free high fat diet PR:PROJECT_SUMMARY + myriocin PR:INSTITUTE Salk Institute for Biological Studies PR:DEPARTMENT Molecular and Cell Biology Laboratory PR:LABORATORY Metallo Lab PR:LAST_NAME Handzlik PR:FIRST_NAME Michal PR:ADDRESS 10010 N Torrey Pines Rd, La Jolla, California, 92037, USA PR:EMAIL mhandzlik@salk.edu PR:PHONE 2069601945 PR:FUNDING_SOURCE R01CA234245 #STUDY ST:STUDY_TITLE The impact of dietary serine/glycine restriction and myriocin treatment on ST:STUDY_TITLE hepatic sphingolipid diversity during prolonged high fat diet feeding. ST:STUDY_SUMMARY We wanted to determine the impact of dietary serine/glycine restriction on ST:STUDY_SUMMARY hepatic sphingolipidome. ST:INSTITUTE Salk Institute for Biological Studies ST:DEPARTMENT Molecular and Cell Biology Laboratory ST:LABORATORY Metallo Lab ST:LAST_NAME Handzlik ST:FIRST_NAME Michal ST:ADDRESS 10010 N Torrey Pines Rd, La Jolla, California, 92037, USA ST:EMAIL mhandzlik@salk.edu ST:PHONE 2069601945 ST:NUM_GROUPS LFD, -SG LFD, HFD, -SG HFD, LFD+Veh, HFD+Veh, -SG HFD+Veh, -SG HFD+Myr ST:TOTAL_SUBJECTS 80 ST:NUM_MALES 80 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:GENOTYPE_STRAIN C57BL/6J SU:AGE_OR_AGE_RANGE 8-32-week-old SU:WEIGHT_OR_WEIGHT_RANGE 25-50 SU:GENDER Male SU:ANIMAL_ANIMAL_SUPPLIER JAX SU:ANIMAL_HOUSING 5/cage SU:ANIMAL_LIGHT_CYCLE 12h dark/12 h light SU:ANIMAL_FEED Special diets; see group labeling SU:ANIMAL_WATER Ad libitum #FACTORS #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 - L_101 Group:Low fat diet + vehicle RAW_FILE_NAME=L_101.d SUBJECT_SAMPLE_FACTORS - L_102 Group:Low fat diet + vehicle RAW_FILE_NAME=L_102.d SUBJECT_SAMPLE_FACTORS - L_103 Group:Low fat diet + vehicle RAW_FILE_NAME=L_103.d SUBJECT_SAMPLE_FACTORS - L_104 Group:Low fat diet + vehicle RAW_FILE_NAME=L_104.d SUBJECT_SAMPLE_FACTORS - L_105 Group:Low fat diet + vehicle RAW_FILE_NAME=L_105.d SUBJECT_SAMPLE_FACTORS - L_106 Group:Low fat diet + vehicle RAW_FILE_NAME=L_106.d SUBJECT_SAMPLE_FACTORS - L_107 Group:Low fat diet + vehicle RAW_FILE_NAME=L_107.d SUBJECT_SAMPLE_FACTORS - L_108 Group:Low fat diet + vehicle RAW_FILE_NAME=L_108.d SUBJECT_SAMPLE_FACTORS - L_109 Group:Low fat diet + vehicle RAW_FILE_NAME=L_109.d SUBJECT_SAMPLE_FACTORS - L_110 Group:Low fat diet + vehicle RAW_FILE_NAME=L_110.d SUBJECT_SAMPLE_FACTORS - L_111 Group:Low fat diet + myriocin RAW_FILE_NAME=L_111.d SUBJECT_SAMPLE_FACTORS - L_112 Group:Low fat diet + myriocin RAW_FILE_NAME=L_112.d SUBJECT_SAMPLE_FACTORS - L_113 Group:Low fat diet + myriocin RAW_FILE_NAME=L_113.d SUBJECT_SAMPLE_FACTORS - L_114 Group:Low fat diet + myriocin RAW_FILE_NAME=L_114.d SUBJECT_SAMPLE_FACTORS - L_115 Group:Low fat diet + myriocin RAW_FILE_NAME=L_115.d SUBJECT_SAMPLE_FACTORS - L_116 Group:Low fat diet + myriocin RAW_FILE_NAME=L_116.d SUBJECT_SAMPLE_FACTORS - L_117 Group:Low fat diet + myriocin RAW_FILE_NAME=L_117.d SUBJECT_SAMPLE_FACTORS - L_118 Group:Low fat diet + myriocin RAW_FILE_NAME=L_118.d SUBJECT_SAMPLE_FACTORS - L_119 Group:Low fat diet + myriocin RAW_FILE_NAME=L_119.d SUBJECT_SAMPLE_FACTORS - L_120 Group:Low fat diet + myriocin RAW_FILE_NAME=L_120.d SUBJECT_SAMPLE_FACTORS - L_121 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_121.d SUBJECT_SAMPLE_FACTORS - L_122 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_122.d SUBJECT_SAMPLE_FACTORS - L_123 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_123.d SUBJECT_SAMPLE_FACTORS - L_124 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_124.d SUBJECT_SAMPLE_FACTORS - L_162 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_162.d SUBJECT_SAMPLE_FACTORS - L_126 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_126.d SUBJECT_SAMPLE_FACTORS - L_127 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_127.d SUBJECT_SAMPLE_FACTORS - L_128 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_128.d SUBJECT_SAMPLE_FACTORS - L_129 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_129.d SUBJECT_SAMPLE_FACTORS - L_130 Group:Serine/glycine-free low fat diet + vehicle RAW_FILE_NAME=L_130.d SUBJECT_SAMPLE_FACTORS - L_148 Group:Serine/glycine-free low fat diet + myriocin RAW_FILE_NAME=L_148.d SUBJECT_SAMPLE_FACTORS - L_132 Group:Serine/glycine-free low fat diet + myriocin RAW_FILE_NAME=L_132.d SUBJECT_SAMPLE_FACTORS - L_133 Group:Serine/glycine-free low fat diet + myriocin RAW_FILE_NAME=L_133.d SUBJECT_SAMPLE_FACTORS - L_134 Group:Serine/glycine-free low fat diet + myriocin RAW_FILE_NAME=L_134.d SUBJECT_SAMPLE_FACTORS - L_135 Group:Serine/glycine-free low fat diet + myriocin RAW_FILE_NAME=L_135.d SUBJECT_SAMPLE_FACTORS - L_136 Group:Serine/glycine-free low fat diet + myriocin RAW_FILE_NAME=L_136.d SUBJECT_SAMPLE_FACTORS - L_137 Group:Serine/glycine-free low fat diet + myriocin RAW_FILE_NAME=L_137.d SUBJECT_SAMPLE_FACTORS - L_168 Group:Serine/glycine-free low fat diet + myriocin RAW_FILE_NAME=L_168.d SUBJECT_SAMPLE_FACTORS - L_140 Group:Serine/glycine-free low fat diet + myriocin RAW_FILE_NAME=L_140.d SUBJECT_SAMPLE_FACTORS - L_141 Group:High fat diet + vehicle RAW_FILE_NAME=L_141.d SUBJECT_SAMPLE_FACTORS - L_151 Group:High fat diet + vehicle RAW_FILE_NAME=L_151.d SUBJECT_SAMPLE_FACTORS - L_143 Group:High fat diet + vehicle RAW_FILE_NAME=L_143.d SUBJECT_SAMPLE_FACTORS - L_144 Group:High fat diet + vehicle RAW_FILE_NAME=L_144.d SUBJECT_SAMPLE_FACTORS - L_145 Group:High fat diet + vehicle RAW_FILE_NAME=L_145.d SUBJECT_SAMPLE_FACTORS - L_146 Group:High fat diet + vehicle RAW_FILE_NAME=L_146.d SUBJECT_SAMPLE_FACTORS - L_147 Group:High fat diet + vehicle RAW_FILE_NAME=L_147.d SUBJECT_SAMPLE_FACTORS - L_131 Group:High fat diet + vehicle RAW_FILE_NAME=L_131.d SUBJECT_SAMPLE_FACTORS - L_149 Group:High fat diet + vehicle RAW_FILE_NAME=L_149.d SUBJECT_SAMPLE_FACTORS - L_150 Group:High fat diet + vehicle RAW_FILE_NAME=L_150.d SUBJECT_SAMPLE_FACTORS - L_142 Group:High fat diet + myriocin RAW_FILE_NAME=L_142.d SUBJECT_SAMPLE_FACTORS - L_152 Group:High fat diet + myriocin RAW_FILE_NAME=L_152.d SUBJECT_SAMPLE_FACTORS - L_153 Group:High fat diet + myriocin RAW_FILE_NAME=L_153.d SUBJECT_SAMPLE_FACTORS - L_154 Group:High fat diet + myriocin RAW_FILE_NAME=L_154.d SUBJECT_SAMPLE_FACTORS - L_155 Group:High fat diet + myriocin RAW_FILE_NAME=L_155.d SUBJECT_SAMPLE_FACTORS - L_156 Group:High fat diet + myriocin RAW_FILE_NAME=L_156.d SUBJECT_SAMPLE_FACTORS - L_157 Group:High fat diet + myriocin RAW_FILE_NAME=L_157.d SUBJECT_SAMPLE_FACTORS - L_158 Group:High fat diet + myriocin RAW_FILE_NAME=L_158.d SUBJECT_SAMPLE_FACTORS - L_159 Group:High fat diet + myriocin RAW_FILE_NAME=L_159.d SUBJECT_SAMPLE_FACTORS - L_160 Group:High fat diet + myriocin RAW_FILE_NAME=L_160.d SUBJECT_SAMPLE_FACTORS - L_161 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_161.d SUBJECT_SAMPLE_FACTORS - L_125 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_125.d SUBJECT_SAMPLE_FACTORS - L_163 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_163.d SUBJECT_SAMPLE_FACTORS - L_164 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_164.d SUBJECT_SAMPLE_FACTORS - L_165 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_165.d SUBJECT_SAMPLE_FACTORS - L_166 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_166.d SUBJECT_SAMPLE_FACTORS - L_167 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_167.d SUBJECT_SAMPLE_FACTORS - L_139 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_139.d SUBJECT_SAMPLE_FACTORS - L_169 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_169.d SUBJECT_SAMPLE_FACTORS - L_170 Group:Serine/glycine-free high fat diet + vehicle RAW_FILE_NAME=L_170.d SUBJECT_SAMPLE_FACTORS - L_172 Group:Serine/glycine-free high fat diet + myriocin RAW_FILE_NAME=L_172.d SUBJECT_SAMPLE_FACTORS - L_173 Group:Serine/glycine-free high fat diet + myriocin RAW_FILE_NAME=L_173.d SUBJECT_SAMPLE_FACTORS - L_174 Group:Serine/glycine-free high fat diet + myriocin RAW_FILE_NAME=L_174.d SUBJECT_SAMPLE_FACTORS - L_175 Group:Serine/glycine-free high fat diet + myriocin RAW_FILE_NAME=L_175.d SUBJECT_SAMPLE_FACTORS - L_176 Group:Serine/glycine-free high fat diet + myriocin RAW_FILE_NAME=L_176.d SUBJECT_SAMPLE_FACTORS - L_177 Group:Serine/glycine-free high fat diet + myriocin RAW_FILE_NAME=L_177.d SUBJECT_SAMPLE_FACTORS - L_178 Group:Serine/glycine-free high fat diet + myriocin RAW_FILE_NAME=L_178.d SUBJECT_SAMPLE_FACTORS - L_179 Group:Serine/glycine-free high fat diet + myriocin RAW_FILE_NAME=L_179.d SUBJECT_SAMPLE_FACTORS - L_180 Group:Serine/glycine-free high fat diet + myriocin RAW_FILE_NAME=L_180.d #COLLECTION CO:COLLECTION_SUMMARY Liver samples were collected using Wollenberger clamps pre-cooled to the CO:COLLECTION_SUMMARY temperature of liquid nitrogen and stored at -80 C until analysis. CO:SAMPLE_TYPE Liver CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY Animals were subjected to 8 different dietary interventions: 1. Low fat diet + TR:TREATMENT_SUMMARY vehicle 2. Low fat diet + myriocin 3. Serine/glycine-free low fat diet + vehicle TR:TREATMENT_SUMMARY 4. Serine/glycine-free low fat diet + myriocin 5. High fat diet + vehicle 6. TR:TREATMENT_SUMMARY High fat fat diet + myriocin 7. Serine/glycine-free high fat diet + vehicle 7. TR:TREATMENT_SUMMARY Serine/glycine-free high fat diet + myriocin #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Samples were extracted with 400 ul of methanol (-20 C), 100 ul of water SP:SAMPLEPREP_SUMMARY (ice-cold), 400 saline (ice-cold), and 1000 ul of chloroform (-20 C). SP:PROCESSING_STORAGE_CONDITIONS Room temperature SP:EXTRACT_STORAGE 4℃ #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY The gradient elution program consisted of the following profile: 0 min, 82% B; 3 CH:CHROMATOGRAPHY_SUMMARY min, 82% B; 4 min, 90% B, 18 min, 99% B; 25 min, 99%, 27 min, 82% B, 30 min, 82% CH:CHROMATOGRAPHY_SUMMARY B. CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME 6460C CH:COLUMN_NAME Peeke Scientific Spectra 3 μm C8SR 150 × 3 mm CH:FLOW_RATE 0.5 ml/min CH:COLUMN_TEMPERATURE 40 CH:SOLVENT_A 100% HPLC-grade water containing 2 mM ammonium formate and 0.2% formic acid CH:SOLVENT_B 100% methanol containing 0.2% formic acid and 1 mM ammonium formate #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Agilent 6460 QQQ MS:INSTRUMENT_TYPE Triple quadrupole MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS Mass Hunter #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS normalized ion count/mg protein MS_METABOLITE_DATA_START Samples L_101 L_102 L_103 L_104 L_105 L_106 L_107 L_108 L_109 L_110 L_111 L_112 L_113 L_114 L_115 L_116 L_117 L_118 L_119 L_120 L_121 L_122 L_123 L_124 L_162 L_126 L_127 L_128 L_129 L_130 L_148 L_132 L_133 L_134 L_135 L_136 L_137 L_168 L_140 L_141 L_151 L_143 L_144 L_145 L_146 L_147 L_131 L_149 L_150 L_142 L_152 L_153 L_154 L_155 L_156 L_157 L_158 L_159 L_160 L_161 L_125 L_163 L_164 L_165 L_166 L_167 L_139 L_169 L_170 L_172 L_173 L_174 L_175 L_176 L_177 L_178 L_179 L_180 Factors Group:Low fat diet + vehicle Group:Low fat diet + vehicle Group:Low fat diet + vehicle Group:Low fat diet + vehicle Group:Low fat diet + vehicle Group:Low fat diet + vehicle Group:Low fat diet + vehicle Group:Low fat diet + vehicle Group:Low fat diet + vehicle Group:Low fat diet + vehicle Group:Low fat diet + myriocin Group:Low fat diet + myriocin Group:Low fat diet + myriocin Group:Low fat diet + myriocin Group:Low fat diet + myriocin Group:Low fat diet + myriocin Group:Low fat diet + myriocin Group:Low fat diet + myriocin Group:Low fat diet + myriocin Group:Low fat diet + myriocin Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + vehicle Group:Serine/glycine-free low fat diet + myriocin Group:Serine/glycine-free low fat diet + myriocin Group:Serine/glycine-free low fat diet + myriocin Group:Serine/glycine-free low fat diet + myriocin Group:Serine/glycine-free low fat diet + myriocin Group:Serine/glycine-free low fat diet + myriocin Group:Serine/glycine-free low fat diet + myriocin Group:Serine/glycine-free low fat diet + myriocin Group:Serine/glycine-free low fat diet + myriocin Group:High fat diet + vehicle Group:High fat diet + vehicle Group:High fat diet + vehicle Group:High fat diet + vehicle Group:High fat diet + vehicle Group:High fat diet + vehicle Group:High fat diet + vehicle Group:High fat diet + vehicle Group:High fat diet + vehicle Group:High fat diet + vehicle Group:High fat diet + myriocin Group:High fat diet + myriocin Group:High fat diet + myriocin Group:High fat diet + myriocin Group:High fat diet + myriocin Group:High fat diet + myriocin Group:High fat diet + myriocin Group:High fat diet + myriocin Group:High fat diet + myriocin Group:High fat diet + myriocin Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + vehicle Group:Serine/glycine-free high fat diet + myriocin Group:Serine/glycine-free high fat diet + myriocin Group:Serine/glycine-free high fat diet + myriocin Group:Serine/glycine-free high fat diet + myriocin Group:Serine/glycine-free high fat diet + myriocin Group:Serine/glycine-free high fat diet + myriocin Group:Serine/glycine-free high fat diet + myriocin Group:Serine/glycine-free high fat diet + myriocin Group:Serine/glycine-free high fat diet + myriocin Cer 18:1/16:0 118.0394651 781.906516 80.44954718 129.4734444 94.8569637 90.80676388 103.7793834 137.5644626 133.0843943 142.3685542 83.01498936 865.5839942 138.7204083 967.0152056 107.3470958 130.8534278 134.1091992 126.2504003 129.3350225 145.5168797 109.2208158 143.9619047 220.5428885 97.10811178 81.24556687 82.32116359 79.54928332 226.5263841 109.6979156 138.8691306 73.97956379 85.42413143 101.1104403 73.57850291 49.00051025 146.9688059 122.7420198 70.51248789 74.37951811 97.86323557 111.0692788 137.9474144 96.99943471 127.4013833 84.90354279 120.662258 85.70911075 140.5877497 127.7895958 143.8104192 90.15161208 110.2877621 72.54049199 61.15672767 69.82778621 84.38029435 67.82507107 88.17213244 537.8681267 52.07708064 94.63693099 90.1083057 57.40786854 52.59900183 106.1295271 69.29605541 82.43205312 64.89645375 63.78961301 46.04049659 279.3095651 50.11499605 78.40463957 78.3744948 59.45632336 77.08852515 60.29352498 67.79138201 Cer 18:1/18:0 30.64480206 201.9517289 25.65948429 34.59209268 21.07588655 23.28609094 27.01991223 47.20485875 34.01320486 42.46377835 22.42547776 190.7257807 39.86270479 224.4241323 46.15360875 44.45050882 44.26304087 42.33480238 52.59534114 44.48058888 30.63692148 49.16758008 58.05857046 31.13743142 27.01774536 22.90144491 26.38684809 57.49668257 42.93636939 55.35749789 37.89579006 30.79569905 45.10049185 24.08807476 16.48596347 45.8406956 40.93181079 21.0139559 26.89041917 31.73195889 47.87619308 55.56254248 40.07112428 58.60446382 31.29087968 37.46750688 38.08857323 67.54883654 62.53667974 47.24630071 47.59701307 34.76385027 30.48335923 34.35072093 26.9526966 47.29415559 30.68168297 32.77569143 49.48954362 24.04556419 61.81054662 29.18997937 20.15805727 23.22603221 39.39345333 26.13266814 26.78413259 27.90839515 21.74053641 26.21171099 109.3895212 21.29869718 24.89150258 34.30344905 17.79640134 28.71350466 26.16677415 22.94723039 Cer 18:1/20:0 498.1062705 700.089201 378.6295721 561.3487313 385.6639651 447.5950458 335.1502679 600.332888 427.228637 713.5459034 541.0500741 713.9184754 512.6507514 733.4561149 651.747156 580.2468041 775.2243363 620.5286992 745.5142446 773.1632734 414.3347944 431.5085383 334.9974919 304.8542705 265.6119623 276.2462091 329.1861225 393.6617355 454.959188 511.0941447 273.3380002 341.5237737 515.6141626 218.4958091 160.8108064 337.3282321 499.2203169 186.2874331 282.0345382 822.2734587 773.1783877 1218.346697 912.3584367 976.9691601 946.1065081 769.8176128 949.2960962 1153.384406 1059.438662 648.2684734 729.25725 783.1562311 407.8371297 583.3262589 312.7912945 698.2931452 662.7386226 568.2236856 644.0472856 389.6587156 881.4710033 640.1203984 450.8543493 425.1738419 636.1048996 588.5585387 718.7905917 428.6835277 557.0617139 317.3401452 428.2714545 301.8736287 339.1976317 528.4630137 289.9200822 311.0653708 290.114416 354.0161044 Cer 18:1/22:0 2843.789715 2094.028876 2129.513528 3200.672816 2090.273004 2522.782034 2820.80547 4194.339518 3434.409312 4164.490794 2752.575582 2455.859363 2780.346331 2207.402499 2155.064769 2545.271152 3223.0667 2997.666184 2610.895489 3263.563315 2806.715908 2880.535118 2546.448287 2442.47593 2227.095861 2093.446829 2516.023417 1463.274943 3071.125819 2364.352554 1285.362445 1767.934017 2502.552112 1039.48287 721.2592119 1047.971517 2953.339644 1357.716381 1714.598419 3639.959667 2897.874665 3726.98876 3144.559712 3371.445829 4044.27231 2926.676383 3475.982162 4163.250473 3913.85013 3521.695439 2798.768868 2447.832075 1524.970355 1861.911936 944.3888854 2525.698821 2519.13171 2812.817023 2752.976303 2283.925134 2707.805305 3943.994266 2770.183044 2680.988881 2524.52178 3366.271011 3853.050591 2870.107511 3218.634171 1590.185171 1802.295286 1435.300626 2010.91957 2954.459413 1732.983335 1730.025912 1841.590021 2182.106558 Cer 18:1/22:1 683.7903659 382.9089835 565.6977731 842.4880444 655.3976591 484.4410602 429.924799 650.1191652 680.9313418 867.2489688 415.455968 460.5709679 594.1708204 471.7446719 647.2961998 728.6112019 933.2412439 797.1871382 755.4091428 1167.677312 483.1553161 745.4420938 555.1956145 499.2731898 354.673726 382.2531762 375.6325376 268.7767057 548.9506841 545.0353978 252.7163217 238.5882241 318.0594144 143.3317315 82.68667122 186.5950247 395.3106689 226.1731015 238.0503634 287.8705047 331.5278565 373.3367685 374.4572456 431.2343184 355.5039567 231.3469869 360.2672826 587.8200552 554.8511737 391.2083309 353.213118 294.1120394 170.1354867 204.1871508 101.8265877 382.4462863 268.1179516 289.0351667 129.2903378 222.8771056 266.7329432 273.1603012 195.2811798 146.997178 230.6508857 236.0837102 266.3947085 222.7299845 217.6710171 107.752558 190.7216144 98.89838317 151.7111927 171.7047091 102.3672724 83.58307476 114.703287 127.0826431 Cer 18:1/24:0 2027.879923 2808.387788 936.5329549 1996.590305 929.8484108 1489.844144 2173.430758 2918.730459 2299.230806 2388.275353 1535.393901 3233.921161 1755.869662 2705.529182 928.8234749 1374.849894 1877.394914 1468.268999 1243.036372 1737.838685 1968.382144 2384.063794 3729.837941 1851.989694 1535.171686 1191.498366 1642.077987 1758.853545 2353.62858 1712.583247 651.8828677 1095.184607 1131.481454 519.758014 236.954463 542.7309781 1930.133395 648.9061171 847.5315466 1492.657649 870.3361416 1164.878685 1272.363754 998.259748 976.5663198 1104.367509 926.267297 1399.090552 1078.162717 1065.111828 761.5371392 759.982221 322.5294299 463.9402261 259.9780106 688.3165371 607.9225851 804.2242127 2677.506939 1049.617862 1018.780195 1463.105597 584.6683369 669.5039317 1011.650537 1144.418533 863.2512222 741.1220196 814.0291364 291.6034762 1152.462414 394.2548782 461.6163892 624.115832 307.2801909 337.4593934 576.0625167 460.2211739 Cer 18:1/24:1 3242.841739 6339.252808 1815.226607 3292.09111 2059.36583 2201.244481 1907.365888 2902.405539 2403.119177 3328.825507 1855.401682 6997.27535 2922.984703 6116.897163 2449.933456 2640.368857 4033.849044 3037.473959 2730.155348 3879.17382 2642.783578 3110.242973 5004.307072 1970.245719 1656.10676 1509.853684 1991.203578 4684.582546 3183.129265 3452.817023 1284.686269 2113.871782 2250.95727 998.8728655 553.8265322 1648.839998 3816.811237 1153.446811 1462.74103 2142.171558 2287.599394 2623.316915 2390.942447 2524.951602 1878.14046 2085.531916 1839.234179 3459.785772 3161.619121 2399.177566 2040.863593 1654.974172 1090.699925 1062.222744 893.8466286 2117.126491 2152.869476 2116.498451 4267.273126 1881.132949 2436.769889 2222.092483 1179.569659 890.3668074 1503.797156 1963.68989 1651.842818 1484.668221 1378.187581 876.8480456 3852.414726 927.4386053 1261.369107 1508.127157 699.1384843 668.1430151 956.1253635 944.4184525 DHCer 18:0/16:0 0.513935966 1.32298414 0.63350317 0.625669755 0.506843032 0.681763911 0.891377606 0.741832535 0.844092753 0.605777902 0.806948026 1.274022891 0.800851603 1.746735318 0.646187066 0.708162693 0.633271621 0.680994087 0.683420693 0.601257771 0.432976758 0.541743104 0.664805307 0.493987048 0.571098699 0.594570524 0.503241302 0.68876502 0.48191645 0.429203709 0.65267111 0.53618178 0.559720472 0.410883423 0.303793969 0.47562397 0.490512866 0.319301677 0.364507645 1.023086055 1.098647961 1.150099105 0.850960889 1.107743371 0.967373221 1.076612268 0.988276056 0.857353494 0.988089634 0.963310406 0.753726502 0.668600812 0.513432523 0.452472188 0.78536418 0.612290111 0.438809349 0.59299063 4.603593044 0.577002416 0.503595217 0.663572619 0.577610239 0.762418204 1.059787185 0.66765362 0.853707826 0.666912826 0.972871755 0.502873366 0.882327418 0.480803638 0.549129405 0.714104536 0.5599557 0.830158405 0.483641174 0.661727088 DHCer 18:0/18:0 1.08215414 1.208881842 1.400735551 1.707667877 1.799297941 1.899363752 1.930676673 1.666718106 2.387537771 1.566417576 2.216524761 1.053899121 1.949923351 1.507798591 1.899101966 2.810399991 1.993434817 2.092558631 3.505581871 2.03842832 1.030018549 1.747040294 1.054907824 1.477090471 1.357817246 1.449305883 1.37672817 0.537859107 1.101672704 1.632875788 1.307805655 0.957522308 1.847848746 0.812822309 1.036354851 1.082712937 0.884777508 1.01694584 1.15690459 1.457435237 2.02257092 1.700882504 1.172878748 1.559469409 0.956992986 1.318655036 1.389659321 1.533941301 1.834230663 0.938354608 2.137673988 1.21396893 0.947975627 0.945788216 1.817302343 1.205784132 0.606697465 0.683759103 2.015197975 1.0041466 1.719788926 0.825533024 1.032420881 0.894758944 1.529448152 0.961406601 0.92877881 1.304987299 1.047362929 0.80090215 0.900066405 0.57297432 0.693340392 0.753698247 0.549705959 1.094590974 0.66278245 0.79252013 DHCer 18:0/20:0 4.700926445 4.262003274 6.459286904 6.794400796 7.164545649 6.392202453 5.867489579 5.033973242 7.684007496 5.986232503 7.292675191 4.082310844 7.536644259 4.899576575 6.63218614 7.82383229 7.427991256 8.288766677 8.925933892 7.895483119 4.701657382 4.81535932 4.052699221 4.278802543 4.591788419 4.134743411 4.154130045 2.452400021 3.926146881 5.058193414 4.76000914 4.041527297 6.55851144 2.956984052 3.9880052 4.497777469 3.077847671 3.577680475 3.930117137 7.199578507 7.99764978 8.077674002 6.327073893 6.389128094 5.25631379 6.679197846 6.864987585 6.388637933 8.441044456 5.311889323 8.973986011 6.418020679 5.671001225 5.515419556 6.747369481 6.669554084 3.77303149 4.074628338 5.911651331 4.002306779 3.936349824 3.295156489 4.348299358 3.520238586 7.227632255 3.640812729 4.999408068 5.05144885 4.639918335 3.653426856 3.423233789 2.566125676 2.462695029 2.649685358 2.969698847 3.338601558 3.595456584 2.711509821 DHCer 18:0/22:0 6.910449125 2.779690149 7.176881981 10.59974707 6.49885476 8.841565199 7.631074585 6.799905327 10.48010286 10.13410356 14.69236747 3.465018323 12.48169871 3.864730826 7.214563919 6.486256209 9.384954933 10.97783422 8.791004325 9.314652486 10.36782961 6.262669304 6.572552191 6.994689991 9.580108364 6.045587077 6.948545851 2.274960326 10.17854469 5.910051949 6.007437372 8.059179605 6.851698354 1.524062612 1.250517619 2.413052881 3.336882555 1.940517358 2.306637711 15.83908128 11.50994077 12.64115853 12.8220027 10.23046172 12.79624329 11.49376061 12.93345175 7.909245945 13.39475695 8.953608761 11.57694847 8.852253656 2.827277877 4.318720062 5.474948851 6.016427228 4.377070229 5.689553445 10.62044669 8.701577225 5.935063725 10.2414264 12.69838257 10.19983781 17.73533695 13.46992093 20.7584747 8.401331192 13.5453653 2.849786141 3.107414734 2.721921406 2.215872918 5.16685036 2.964719363 6.209210977 5.211023131 3.508207352 DHCer 18:0/24:0 2.329180359 1.545502451 1.700583731 3.071633966 1.399710859 2.10418345 3.099615188 2.636429981 3.725671805 2.268572624 3.546769847 1.927044267 3.080681018 2.222435502 1.407986306 1.631313722 2.440999526 2.459247755 1.612069032 2.15347141 2.487374014 2.158744407 4.432629725 2.073563204 3.113705494 1.471942906 2.046327919 1.401519124 3.180642035 2.133550478 1.422611071 1.904112576 1.306826212 0.438149297 0.28500389 0.630799808 1.103223371 0.480605017 0.590206941 2.509206748 2.033607918 2.387492032 2.064057436 2.053842115 1.598196965 2.707297837 1.657910312 1.638883484 2.121678631 1.595883824 1.675487444 1.383640475 0.529796581 0.672578579 1.274936691 1.065186391 0.749551731 1.128518181 4.247932023 1.472791901 1.543013889 2.090558036 1.38823226 1.442601918 2.492968169 2.246983815 2.643032711 1.280609556 2.142027367 0.568927528 1.266758919 0.326720646 0.527922732 0.904443052 0.539637951 1.051025328 0.836578412 0.677897669 DHCer 18:0/24:1 1.866098907 3.49318726 4.180303078 5.536603493 4.400496308 2.066324489 3.00246887 1.866474031 4.66678995 4.901476961 5.179634842 4.483392755 5.727339368 6.16282074 6.317389164 5.447783932 8.776781732 6.716487529 7.703732203 7.852749347 1.384207399 1.826770014 2.276104664 1.281860448 1.978505711 1.166432502 1.2582958 2.831003422 3.256391837 3.792810708 3.565475062 2.792642384 1.229734425 0.755563974 0.877868728 2.661277934 1.492981312 0.960696635 0.847496057 2.559727402 5.371887744 2.990667806 3.209668095 4.687503126 3.267582944 4.719372693 4.451620537 3.331291695 5.61513259 3.553564432 4.529664856 3.571408064 1.676583312 1.887510813 4.29345955 3.440020232 1.77761252 2.59701551 3.865514654 1.637271966 2.661396715 1.396958727 2.456028105 2.079550558 2.668777952 2.727163514 4.075770423 1.95239793 3.203971383 1.108972336 3.753602067 0.494981303 0.971579796 1.378046728 1.02864509 1.646114211 1.203537949 0.9575409 doxCer 18:1/18:0 16.99178561 14.45956912 13.08030646 16.81827272 21.56590349 17.15853627 11.69051004 9.805407298 21.10771612 26.74028429 14.49071171 13.91275686 21.28137448 13.32869895 16.93311002 35.1703152 12.49402708 28.45035009 29.9888929 13.90961299 16.33714792 31.16320125 20.41013878 26.87406607 15.02071874 21.1503189 15.56852482 7.807879633 13.63967703 59.83784749 8.333942756 8.905545027 18.04935885 12.03047258 11.35113898 16.33978827 16.53563256 13.64621183 8.122917296 9.320737261 13.93737074 11.8353599 8.226213655 10.16370405 8.363353046 7.314553674 9.826593742 22.95096995 15.83472537 5.461007847 20.47406977 11.75144017 7.356125921 11.14946199 11.64916549 11.4981204 10.18346464 5.128406487 5.741662981 10.51558666 19.27519615 7.160842309 10.76413572 9.352736001 16.4954031 7.289845592 9.0910648 10.03556248 8.035371075 8.881116061 7.258266588 7.151233093 6.05158186 6.217956626 7.942454613 8.261201701 6.339742981 6.813910341 doxCer 18:1/20:0 410.9143294 361.808189 427.1739303 492.8539508 548.7390242 493.9482218 287.6277823 317.7434892 514.7548658 580.8050337 370.3287721 399.7679957 553.3221806 441.8849242 473.9638217 658.1518713 586.4533794 719.0827562 655.789798 522.6122207 456.9670435 718.6587521 493.5744635 448.7242708 263.2440866 377.9361641 342.6371256 306.5658328 317.2449723 887.2959031 265.363796 296.7069533 520.191946 231.4456739 288.3072141 488.3935926 451.3359736 344.1689601 252.2993027 317.2414905 385.82028 314.8104792 353.7825139 339.6603512 290.069059 328.3982374 319.9114656 558.5828754 478.7100116 268.2381883 568.7800866 414.7025116 332.2343361 319.7801623 376.7188904 422.809751 358.4505345 271.3712512 239.9060372 174.2526619 188.5718335 195.1847436 221.2587984 160.8107123 393.0949381 195.9165083 241.5576818 243.4787785 219.3889066 165.6112327 216.7747684 178.383928 184.6714711 194.1687207 177.5903926 183.0900545 196.5852687 201.3211608 doxCer 18:1/22:0 51.47909017 34.1402274 60.55445768 71.52816198 100.8686979 89.85696985 28.49528351 21.90098335 58.62965159 52.46460034 42.55054016 33.65054086 75.34992031 32.88112923 73.65559158 82.85000767 89.77143705 145.5927263 97.16322434 89.32626738 116.1188923 196.7434463 152.4516316 128.6002606 96.66040607 177.4535165 109.5453996 88.40931883 105.6797071 545.1395919 79.25572899 101.2256567 164.9638102 56.85159428 62.02570566 164.9800742 124.7093818 98.19826132 84.47447313 121.8634582 112.9463331 135.9734525 117.3247343 94.1213623 117.6370862 64.04150605 114.9980843 171.9647625 163.5633594 63.83589407 144.2739249 102.2956488 70.39992791 81.17341005 68.95129852 74.40368624 74.71774683 55.9915828 75.20658789 117.9763029 126.132083 162.0911193 194.4985668 106.4892874 223.8313766 100.4441722 235.0764702 179.2627486 155.7941058 70.87772044 81.27909548 83.11635152 94.01273767 114.4771098 113.9446956 105.7876082 77.79667811 121.1975776 doxCer 18:1/22:1 184.1298937 189.7970333 216.648946 215.4598698 292.1713118 229.0202374 112.4093683 121.0379079 251.6781868 344.128765 149.6222542 165.7537068 233.0930743 223.023596 288.7736838 364.134295 295.4325253 466.29802 334.6858467 275.8267204 190.7615737 347.9948537 228.3843964 194.0000149 102.7204022 134.018903 121.2834226 84.33962338 137.7142157 470.523537 110.1133012 130.6252371 247.3802717 76.77376749 129.0104937 269.5582906 146.5818174 131.6662766 81.08555116 81.3814807 125.0777256 92.85752519 95.65412119 96.14260245 84.90939538 97.60083761 97.24174932 187.357871 145.2454082 81.71145732 215.4584648 110.5060639 102.9019686 87.03055122 130.1738238 149.4784577 117.1726337 97.76142152 62.36120457 63.18858919 60.66283206 70.33549539 70.98427905 55.0983295 118.7792321 60.46014325 76.02854292 79.34512935 63.95153484 64.63706653 91.79189847 48.66361278 57.90209105 56.3487103 49.51318974 64.40949141 62.43917732 61.49429046 doxCer 18:1/24:0 10.98077251 13.84822704 9.94046666 20.23323182 19.28087712 25.12112988 18.1114544 8.177396033 24.25841299 26.0272593 16.21483255 11.17388424 8.354671315 10.13028329 13.1695602 20.77522416 19.58943892 23.57296694 19.77852972 17.71740726 51.74320412 113.225913 132.3441206 70.36579788 56.78172205 57.55002684 52.36283377 60.2182322 56.14787666 246.9575649 23.16649555 40.32526683 54.72725286 6.79747323 14.50773798 43.50490948 60.79682509 31.71004433 28.19682512 22.2430098 18.32147182 25.91946622 15.91371951 24.34401193 24.61892553 19.21696533 21.23296255 33.48802648 29.59565761 13.33975545 24.99204866 15.57030384 8.869502189 16.55428767 14.1890196 14.24899146 14.57593999 14.80348177 26.54041012 29.01467163 35.04898897 38.11045703 30.53216948 21.13223166 41.23997559 29.6587466 40.02308141 28.93867249 31.62535845 15.3966674 37.03811776 15.72097022 19.8485177 22.24976727 18.70032257 24.67544273 16.66989009 28.03682367 doxCer 18:1/24:1 24.04098083 43.41667891 40.02234027 37.23748353 71.53473633 37.84652558 16.44597175 17.76374371 25.79795806 44.38488194 23.12798556 23.26072603 29.97113481 38.95143102 53.58905422 68.73548062 62.19615724 85.37944383 73.9652792 68.73038489 62.89916408 138.150316 127.6361513 73.28799363 46.25397648 64.13195014 49.22763754 123.1011835 66.3580786 405.0678868 48.85449177 53.82460646 68.97433561 29.33916051 25.53668306 113.7749279 71.40366557 48.21560653 38.44921172 37.00059348 50.89692596 49.45840163 27.82644166 55.16576791 43.44963822 30.73705549 46.63282736 93.97253214 78.42133593 22.83905786 64.05342716 47.56143794 32.47918766 33.59992314 44.97810002 47.84085867 40.49696741 21.8996093 12.02201746 32.60411554 64.46135945 35.87659371 55.05489775 22.94002888 69.65997869 31.72162244 49.95743502 54.12261766 47.8377822 32.37037795 70.0893682 22.38371186 43.48945586 35.56456946 38.56248525 32.21075473 19.50298443 37.17999103 doxDHCer 18:0/18:0 0.287645844 0.32701794 0.282965019 0.301408265 0.4605311 0.360613404 0.240256723 0.146283073 0.4050857 0.336555707 0.325620712 0.241050671 0.354914258 0.33509369 0.515735522 0.461934398 0.490952175 0.642020272 0.682033532 0.417316754 1.039395635 1.273550202 1.245048456 1.189284064 1.053467637 1.464289947 0.909440177 0.949808659 0.898605719 4.313226502 0.850815031 1.357620311 0.905889387 0.323532873 0.459316556 0.734437989 0.601974796 0.625126648 0.373800254 1.028480634 1.896276923 1.665981059 0.845451121 1.162045266 0.893634045 0.688765152 1.183028627 1.487887813 1.63081725 0.457093881 1.043062462 0.778386344 1.019619268 0.814249785 1.354656099 0.759600742 0.522633914 0.399664733 2.074662482 1.319729309 1.405787173 1.375228131 1.946165627 1.55319962 2.91294025 0.907073746 1.866617051 1.872694811 1.760714549 1.018818811 1.183629798 0.869309724 0.991327809 0.765426852 1.523504031 1.421779211 0.806922897 1.491870769 doxDHCer 18:0/20:0 0.427121827 0.505100372 0.589048227 0.559786887 0.987838347 0.625111654 0.398836522 0.320246904 0.592192693 0.586912588 0.678312485 0.555090287 0.567526002 0.574809514 0.86196498 0.92086101 1.037805375 1.076012565 1.28886042 0.820652893 1.634195078 1.993364444 1.675195963 1.726569718 1.689597506 2.529052534 1.549213032 1.79835953 1.28791003 6.146284008 1.811369165 2.515209902 1.814836468 0.650856367 1.061387273 1.45892024 1.055802535 1.037545948 0.745580376 1.355837345 2.316835935 2.116121236 1.20846413 1.502798255 1.221850601 0.938230229 1.76607015 1.80374884 2.264933262 0.556418787 1.747484712 1.063413448 1.688062577 1.138060749 1.949550043 1.224617517 0.772464575 0.486084823 2.177451895 1.573651438 1.633040973 1.894982666 2.999384672 1.779383687 3.721455182 1.30944373 2.501600774 2.488362507 2.496189197 1.898883716 1.496779868 1.248173729 1.47089035 1.28042864 2.20005962 2.138217739 1.052880612 2.277518403 doxDHCer 18:0/22:0 1.733789921 1.215132991 2.061446117 1.899159828 2.675739181 2.103154509 1.680094685 1.137094886 2.099605069 1.680802522 2.490729656 1.16884395 2.158114454 1.36223048 1.900619628 2.931805169 2.705103347 3.229630173 3.457668566 2.080431079 5.622786217 6.561063701 4.754188078 5.900770352 5.675532405 8.285901346 4.739885416 3.11725548 3.650467274 16.5236816 4.324492241 5.794602237 4.442478522 1.368879887 2.052091058 3.508219286 2.547233771 2.75117333 1.673502956 5.815483846 5.588619226 5.163966294 3.985317121 3.599516321 4.037767624 2.508992181 4.758059897 4.557877688 4.889349939 1.71219196 4.331386665 2.872584096 2.974554406 2.553772044 2.789119889 2.621383356 1.474189104 1.388326026 3.866211713 5.570109484 3.271646535 7.130047031 8.315901881 5.762187359 12.63871155 3.749746329 8.124612125 7.034068267 7.053030147 2.90839141 2.261997427 3.097550239 2.859534715 3.027784673 5.076674828 4.067558191 3.671682241 4.981023787 doxDHCer 18:0/22:1 0.400822066 0.211032766 0.570505091 0.543792976 0.993497927 0.510475571 0.295546856 0.194089927 0.387913895 0.478642092 0.413630461 0.228426476 0.498606116 0.153892146 0.470070737 0.7756328 0.674020901 1.146374969 0.893444432 0.682247862 1.208828709 1.517293611 0.916007243 1.145615958 1.015587214 1.654576833 0.741681407 0.36023386 0.616390322 3.080871575 0.67749139 0.882716449 0.747349273 0.195715775 0.266812823 0.643323634 0.333065355 0.487600069 0.308827745 0.71328313 1.066580267 0.768113247 0.674297366 0.748685943 0.576156902 0.353209673 0.66428302 1.046893099 1.272313353 0.366738114 1.04424609 0.504565209 0.653992461 0.422292781 0.521486759 0.517824838 0.307097835 0.303356097 0.2267587 0.725460686 0.513300123 0.658864802 1.134458484 0.601902503 1.534255451 0.380719644 1.025837007 0.994923147 0.837426224 0.427179459 0.342736746 0.360816821 0.409378552 0.336211438 0.585034853 0.443088048 0.356342131 0.624804264 doxDHCer 18:0/23:0 0.506924774 0.456070276 0.410702125 0.588729843 0.582764233 0.588917157 0.51667038 0.4405018 0.593412548 0.513800176 0.62509193 0.608683568 0.475913496 0.628321172 0.456209417 0.699446949 0.815912532 0.654173397 0.872112138 0.648073029 1.61265496 1.844319054 2.828696308 1.522505301 1.714648969 2.050599567 1.235820606 1.631920354 1.496630473 6.803691097 1.11858588 1.297037072 0.927861493 0.262716673 0.437720575 1.06234413 0.567499962 0.579819245 0.401930598 0.961262476 1.229664256 1.220907221 0.882159513 0.965129246 0.572672879 1.029268837 0.751848705 1.180225993 0.983151227 0.427030657 0.644220453 0.527043063 0.719896469 0.553956308 0.646009711 0.518309658 0.291653324 0.316336827 0.685691715 1.072838104 1.040180491 1.221133226 1.502495567 0.915309723 1.680373094 0.893801041 1.405110192 1.369026422 1.367295948 0.673942326 1.010308509 0.40668014 0.596283396 0.526962388 0.888892418 0.873459816 0.540279546 1.152423341 doxDHCer 18:0/24:0 0.619321975 0.45189029 0.434913469 0.466634066 0.519473559 0.742713508 0.521925533 0.418280466 0.645397138 0.400533727 0.584581335 0.435960078 0.632656768 0.47606923 0.324914728 0.565634654 0.658869156 0.988677693 0.593517636 0.47186856 2.610872956 2.459142674 4.596755727 1.863049344 2.048201958 2.496831432 1.745573413 1.668659436 1.458526819 5.387778539 1.002014227 2.393129372 1.785206595 0.369851608 0.504084866 1.073777398 0.915664203 0.700114892 0.572455027 1.064016348 1.350851583 1.238639406 0.781018418 0.805701022 0.646196548 0.71782538 0.807793449 0.9909929 1.135548034 0.559200881 0.694912407 0.367456889 0.815434892 0.41062758 0.606679704 0.455245791 0.372430809 0.317625236 2.508554987 1.709541153 1.339939548 2.119924484 1.839570513 1.325572292 2.618159924 1.276420265 1.897089681 1.919652223 1.823293324 1.003811481 1.729176864 0.806223872 0.975506958 0.907304316 1.273621165 1.27810176 0.900392687 1.472573876 doxDHCer 18:0/24:1 1.233533569 2.367001341 1.407982759 1.889054889 2.96354955 1.391853951 0.975719115 0.836590442 1.336820345 1.527344752 1.615585594 2.22383195 1.584231151 2.916774887 2.045539556 2.952415339 3.442262458 2.955472431 4.009233942 2.901023055 4.633299783 6.977504233 8.11343667 4.823881274 4.425431781 5.975423035 3.663071558 7.518099219 4.335319993 24.64643735 3.531730636 4.737046288 2.986880583 1.084583272 1.343837477 4.626920634 2.620202153 2.376360457 1.584339361 3.187596376 5.242024568 3.995491658 2.648829841 3.334656058 2.04303851 2.020042307 3.00143549 4.459065753 4.975017025 1.569972979 3.51492785 2.256618377 2.688997509 1.893015036 2.969481739 2.349063804 1.396727558 1.12310686 3.350602429 4.082540199 3.358328243 4.137138168 4.98580831 2.898224558 7.346400812 2.669713399 4.66375991 4.93530014 4.087113374 2.295208688 6.353258659 1.996196224 2.56062161 2.040339181 3.042573778 2.250418269 1.934125354 3.070038533 Gluc/Gal-Cer 18:1/16:0 150.9660017 309.4919991 167.9070519 239.2464766 216.4191494 175.479936 127.6179325 72.81219641 193.2678075 188.0132407 187.8076511 270.3466024 226.3250887 315.8147576 252.2844919 253.2773853 384.6610794 268.2576979 234.1778515 208.7585995 110.2824176 115.7746536 195.1056992 100.33886 101.1325404 120.2470183 122.0705943 265.3065708 152.6000913 111.296195 142.3953803 149.8362873 124.9449685 199.0359448 104.693519 193.0671684 161.6673792 84.78766208 124.6922626 245.729384 326.4628627 280.5281151 260.2295296 275.0341468 256.8375474 249.3159964 290.0618846 299.3233151 356.0009838 282.0717423 203.7964349 284.9300348 229.903909 193.0702955 278.7686672 230.7894936 290.3982289 271.7984247 2365.912402 146.6410265 208.5140909 230.451591 117.8540434 135.3645044 194.1590235 179.2409172 179.355483 197.6906041 204.893429 204.3668092 373.8444845 262.7907458 269.9259263 226.6056373 229.4825318 241.8221486 208.0243813 173.7436752 Gluc/Gal-Cer 18:1/20:0 4.704545953 3.706205569 8.045018136 5.65628663 9.088056153 7.245738437 3.157598103 2.906843857 6.922229525 6.115559604 6.277847197 3.443553798 5.811003434 5.245087507 10.95087118 8.541161932 9.795673325 11.32391478 9.39668487 7.098171237 3.385897943 3.093469004 3.107479781 3.106077198 3.934158395 3.333689017 2.96581211 1.331966748 3.160102358 4.33070441 3.16619428 3.158796405 2.915186811 3.790423623 2.387677409 2.878773326 0.172026312 1.908215363 1.428188149 5.253503437 11.48927073 6.133711774 7.274548751 6.551749145 6.571382422 6.518406937 8.711466999 6.043248169 10.34356408 6.101119622 5.483454284 6.216188634 8.063349861 6.733988804 7.022723141 7.546934804 6.80829454 4.943867771 7.365958139 2.80445268 2.959266889 2.287653768 2.890209347 2.125932441 3.477970739 1.496783633 1.742419231 4.14877057 2.826137175 3.417738924 2.115616733 2.810903257 1.881466142 1.057981416 2.716449931 2.028980945 3.022123935 2.146923052 Gluc/Gal-Cer 18:1/22:0 383.7828803 179.1655445 415.4534462 427.5040069 408.5775439 450.1127008 324.1684692 260.888314 491.6545455 465.5919797 549.9848136 152.0069556 432.9685331 183.1785128 479.372198 414.0902582 505.6287349 587.3524507 359.1575414 398.694807 312.914486 298.1621513 194.4060101 318.1349113 341.1941067 280.0803666 283.3296522 142.9931467 272.2029257 334.1172823 303.2232647 283.1342236 263.1963377 185.3332157 177.715801 211.6240089 152.8733941 152.163015 209.4558647 337.0281473 460.0437917 405.3614801 356.0223859 372.7710086 370.7330138 323.8789046 439.1541927 373.1742744 485.1887793 375.1253989 332.6493091 337.7796695 310.5259945 292.3073732 269.519938 356.0350418 377.6214092 317.7092561 604.388864 269.3236668 266.5857374 156.7266138 173.0282897 187.6734897 252.4173397 182.9117855 225.9715929 275.5896743 247.3476495 279.0035176 198.8582904 175.874759 184.0197112 179.3376376 212.0479378 177.6677034 271.5724261 159.4927695 Gluc/Gal-Cer 18:1/24:0 147.7368389 98.03420205 90.62385508 114.8392269 100.7754438 142.0677249 102.5746987 70.26963025 137.2334833 109.5298002 115.381866 92.74144047 141.9452215 83.95642042 101.9108049 95.44700796 119.0884414 148.6265663 66.40263129 81.06494662 130.596504 106.8898975 170.7114768 112.5829223 116.9941452 88.11345387 99.74329648 82.40743528 99.62926666 94.31311826 86.76284594 140.5916613 110.0722604 69.04632523 43.98413669 59.77227525 105.2840351 55.43933476 70.95094048 84.94979843 86.33958442 89.37563125 87.57524441 71.70113608 71.40165943 75.04813613 74.2623806 81.26935472 97.58957792 102.0927074 68.44582573 71.40328678 61.20698851 53.72211607 58.90169695 61.84259261 82.08573129 74.15468736 493.799842 79.76544629 60.86486451 60.07845258 40.23264072 41.2010557 66.42739604 58.82781915 54.40630619 72.51786306 59.87953948 67.46434916 94.47172753 67.42850363 69.93942483 59.30009143 51.60423727 55.16504113 82.16171879 50.23681381 Gluc/Gal-Cer 18:1/24:1 155.6165129 301.8710395 133.525202 176.5236724 146.3536085 138.5541765 96.8350804 66.06890888 131.0582919 131.819036 122.1122856 204.1885886 154.4289609 230.0882196 188.6064889 134.6853537 199.6232943 181.1589679 121.8035661 155.5616904 118.8590715 91.63342146 174.7033736 106.7363381 117.9630778 95.46243597 99.56771605 223.1221015 129.6789199 135.8870874 135.0736543 170.9431004 111.2171076 99.65179836 56.60508248 101.5885222 127.2208304 67.03838877 96.99069128 89.4494359 122.9171286 98.98939805 108.6901068 105.4184873 79.37340755 88.35839336 88.96411625 110.5939081 134.1329807 132.7660503 82.29105727 94.63044323 81.97453698 70.89778579 80.01445509 107.9833336 145.6317236 105.8342818 608.2162337 89.05464287 74.94835196 57.87019677 43.47986791 46.94565388 67.21001634 54.91136456 54.37788173 85.88396162 61.95668966 89.74045856 158.1241962 81.54681708 78.68499061 58.86850958 66.21848855 49.12118477 92.0943721 49.00873035 Lact-Cer 18:1/16:0 5.721179986 17.24650475 5.260018325 8.128501591 7.113303686 5.656849156 4.467750011 5.836618727 7.502470549 7.503394892 4.894424398 20.22879829 8.397181826 19.42995314 6.037599897 7.660438092 10.08048448 8.44496193 8.345425078 8.63803858 5.522796341 8.260084501 9.614454053 6.231754645 5.235819452 5.557880424 5.480379114 21.033145 8.311813847 7.223598643 5.679657529 8.103154411 7.139611808 6.934918188 7.663975425 9.851350871 12.27384018 6.047860789 8.274639217 9.874984878 10.66646565 10.52844671 8.588686223 13.14868591 9.703559024 11.47732151 11.62207935 12.21914049 17.45265542 13.72901716 10.00772835 10.47566788 7.936735819 9.197332749 11.08001827 14.2408774 13.29677518 12.48857107 34.74540325 6.151660415 7.985713295 9.345388867 5.56417283 4.884128609 8.906082712 6.813536147 6.508407642 8.012913841 7.649410084 7.977609831 16.38452496 6.875829905 8.039286219 7.386499378 6.924933365 7.164369805 7.049160969 5.508606356 Lact-Cer 18:1/22:0 2.178826028 2.213775111 2.704751874 1.459019115 2.072615255 1.944183324 1.832186002 2.342038264 2.645069984 3.090676409 2.560365256 2.335030774 2.389253393 3.458687635 2.938703701 2.019165812 2.550035301 1.572521727 2.739331727 2.168187736 4.072851554 2.520920976 1.711361755 2.176296802 3.687255745 2.590572114 2.906642332 3.35985225 2.967527861 2.361576098 5.071122794 2.569639367 2.813974401 3.587604735 3.35236256 2.740381181 2.743374083 1.750781904 2.835449773 3.373155326 3.924798922 3.612309831 2.55637721 3.864888009 3.696864449 3.969175605 3.973066127 2.723689249 3.422089297 4.369279425 3.553265036 3.122969853 3.349464082 2.126566951 3.699183315 3.360187525 2.67605338 3.425364232 3.127956897 3.255845579 2.998187 2.526525236 2.422003177 2.206527925 3.244720836 1.60875159 1.606165734 2.316648706 2.295517322 3.817344714 3.379978424 3.026929385 2.557578012 2.499089951 2.449877509 2.224770152 2.424808395 2.025232359 Lact-Cer 18:1/24:0 2.872921641 3.686301198 1.483642824 2.747484183 2.458968365 2.150004281 1.608268968 2.656494726 3.23661284 2.670686214 3.384829493 3.415159641 2.988331702 3.937499138 3.000255497 2.7707037 3.61347451 2.560172779 2.497625986 2.546018481 4.048766092 3.072640091 3.761043524 2.756804543 2.965290233 2.101060222 4.09065547 4.682311578 2.810217251 1.975391701 3.184874233 3.6484617 3.562586883 3.131769777 2.967158388 3.807071006 3.811764707 1.83349601 2.522293886 2.607228521 4.280089518 2.702560354 2.892234681 2.470617995 1.852896057 3.23308287 2.120677102 2.422486604 3.507239876 2.645048042 2.696237099 1.485183343 1.736405265 2.778122666 1.682009475 2.786560471 2.026833329 1.860509179 6.143978955 1.31492309 2.305037421 2.027198049 1.375163248 1.591676823 2.984111405 1.033634162 1.681247196 1.788860839 1.691479493 2.61976115 3.442237544 2.435080087 1.110493743 1.949965591 1.227356397 1.721235945 2.965442517 1.417085296 Lact-Cer 18:1/24:1 3.072342005 7.719959001 3.077531148 3.370118169 4.050019256 2.726589819 2.851159802 2.823135734 3.34380517 4.311953081 3.968788016 8.109626433 4.961054216 7.013500307 5.486001109 4.640436663 6.057324376 5.01629396 4.575966504 4.125431099 3.860899492 3.55084424 4.0930398 3.100089455 3.609827559 3.052298689 2.828912027 9.031658777 3.239401632 3.603607531 3.157688832 3.383861654 3.870117179 3.308994577 4.31077728 4.94741745 5.299076917 2.862556796 3.161864276 2.453359297 4.543513699 1.584800858 3.253570995 3.267004781 2.672617921 3.767159044 2.886299198 3.444910659 4.618213937 2.985864103 3.112507811 2.276715929 3.135779392 2.624244614 3.344424725 4.579470447 3.906116647 3.15857158 5.280629686 2.084934786 1.834955978 1.789841816 2.026035355 1.568556688 2.38995748 1.371607186 1.336450021 1.936700578 1.985687574 2.555699097 6.190631788 2.834409156 1.934758042 1.818256797 1.990525476 1.819105974 3.044284993 1.401689168 SO-C18:1 114.8813289 160.2263872 122.3555923 150.9601045 136.4699095 106.7210248 87.07659872 114.7965987 134.3950552 138.5183744 120.369185 149.8405248 131.6936165 161.5858626 150.2550101 164.2731228 241.0862165 153.3110907 188.699008 195.329872 124.4564351 126.7481077 121.2945264 89.49373496 106.3075658 100.3150163 108.7484436 171.748626 134.6558237 123.6187487 94.00134241 83.72277809 87.66660155 69.22908141 70.43678297 126.696574 100.5673707 88.18660537 69.5473301 161.983629 178.1773743 204.0011539 137.0398395 200.5639809 158.1806552 157.3250456 167.6661179 182.8500584 208.007393 153.9040741 142.0232228 121.2812316 127.0730026 99.45416404 138.3686907 134.9345384 100.9556922 139.4742534 227.2502249 102.7506239 158.7495135 143.8067151 114.4315483 105.3949069 146.6493492 119.4652083 136.7844918 111.1807612 148.8638436 79.75433792 215.5215761 70.32729345 84.35964397 85.61372265 87.79848239 77.74139532 84.10427892 82.52274611 SA-C18:0 8.387329087 15.71769246 9.407170413 15.04744045 8.206154921 8.305009283 7.96416126 7.842044735 10.49104695 12.88989666 8.082914645 8.086062974 10.22390123 10.38969854 10.6829725 9.039062199 14.71863617 11.29078332 11.54615594 13.85128413 9.306934244 9.644705753 11.7831466 6.967285529 8.884309029 6.747650596 7.604562446 12.89043481 13.07526102 10.78982305 9.656516035 7.727614148 11.49663809 4.105075744 2.998454713 6.09889515 11.65605682 4.476610857 3.902229838 16.33254912 14.95667457 16.48992736 14.35953018 17.63872278 20.17122309 15.19132746 14.42766808 16.02412767 22.82318364 11.25562393 6.841918814 7.918327513 5.091093668 3.841116397 7.024598882 7.367180677 7.67734414 7.049046707 44.82487289 12.46704916 15.39958386 17.91502112 13.13346828 13.86859482 15.44727422 15.15684558 15.00298832 12.19202748 17.08915315 5.405132826 8.320995212 7.483211065 5.686221516 9.810058484 6.19521493 7.53417744 8.489800421 7.163333955 doxSA-C18:0 2.593155343 9.003832787 3.045523321 3.462715081 3.499022773 2.947473654 1.896587 1.658368137 2.633443455 2.741527009 3.293094962 3.028854131 2.728011593 6.016751417 3.896385574 4.88545879 6.667019699 4.126770785 6.192790167 5.223616463 9.07031793 10.41135957 8.855369582 8.847999554 6.184834925 9.347258588 8.538204504 17.1912979 10.45649673 42.9012943 10.09570846 13.10808239 7.482362148 3.248973692 7.706707183 20.71765823 5.35011805 4.3631736 3.597323077 4.978501895 8.576045962 7.305291489 5.313668872 6.297899232 4.612393171 2.877497006 5.882390241 6.699056269 6.906170807 2.082656501 4.034962914 2.705334652 4.618058534 2.779269824 7.980063011 3.660634051 2.496058941 2.513999489 6.649299973 10.62190314 8.102934559 9.977522792 8.616737896 6.810610481 14.1114578 7.162063554 13.38400807 11.08760228 10.09312204 8.826703166 13.5382001 5.168933471 6.520810133 5.290376022 7.154103669 5.742980859 4.319414652 9.32490534 SM-C14:0 84.49823015 70.97137255 45.99478445 90.52600303 49.01535131 52.58398265 60.93655691 58.45376787 59.06024082 88.21371552 45.94964132 74.44490983 57.23628132 67.24351265 59.71085206 54.85937708 103.7384072 56.3455613 53.50429142 80.6340539 80.52455153 74.68841027 106.6276657 53.53275503 47.25595665 48.40556215 63.65490454 73.29895725 97.72833063 83.54035132 50.04701457 71.07887881 60.62823485 52.59726558 40.79696791 54.53078613 72.55998038 53.61130207 71.07343239 66.67839426 52.98335827 88.93225889 85.32504062 67.90565651 52.55437535 57.73257937 44.12657777 111.4196367 60.81627775 65.19995463 41.55257639 55.13882115 42.35823128 50.0979226 33.70378061 51.57950356 83.39040153 71.40605158 68.99660021 64.36058256 108.2123673 79.37077414 51.73718488 45.5726684 55.65681586 64.62480674 69.78846394 61.04155836 44.27051977 44.57158843 41.18150822 50.45901225 58.38270187 62.93463847 39.96524306 51.33289209 44.66691067 55.79343586 SM-C16:0 5302.185202 7372.391213 4225.924853 6259.978972 4773.104757 4829.826439 5499.015488 4524.445889 5513.441251 5526.850663 5178.071659 7693.131112 5605.689216 7710.93579 4486.386823 5118.625879 6216.853731 4909.550737 4702.535933 4871.863552 4559.05686 4906.817908 6345.890299 4618.720601 4683.008573 4435.113605 5510.903441 6574.05032 5641.523762 5162.148061 4985.216839 5519.124388 5208.312361 5090.943208 4433.629559 5738.093636 5024.019081 4225.663049 5135.262418 8455.255849 6747.346098 8524.963512 8402.731637 7616.627853 7126.190204 7829.441055 6506.840416 9161.392695 7728.329269 8732.224998 5643.796119 7132.508276 5732.096204 5729.52014 5191.854746 6373.448279 8471.186151 7858.062108 14078.95436 7425.796781 6978.441228 7825.567625 6328.511655 6090.042581 7327.772594 7216.359417 7179.406895 7248.027929 6497.325224 6505.267664 7090.207245 7084.43843 7749.040079 7717.268661 6245.305789 6908.051307 6561.54599 6961.962592 SM-C18:0 201.1170255 363.3666704 145.3078582 186.701812 146.4560105 187.7004932 224.6983905 192.7862527 216.7167251 202.0712877 209.7085249 286.4532321 204.9000775 316.0373138 204.1211417 173.7122759 208.1096229 210.2777114 185.2528824 149.2962429 224.0703179 216.3691306 236.7918533 243.1127803 265.2478148 222.9882098 295.8612305 216.6240235 282.3141469 222.7820493 330.4429407 327.4260779 314.9618502 305.2649208 229.4438376 235.0997603 264.824226 219.1293477 239.3889297 433.2528995 366.3510499 411.0656682 359.1576278 370.5003858 303.6792891 411.2130627 314.4945802 382.2625392 288.0247942 313.3958132 269.7826841 286.3282591 258.7353232 281.063708 303.9729128 280.1902116 331.0449526 281.6239459 519.756761 310.1226236 549.565964 353.2055841 331.9495307 344.1636953 375.1285068 357.5422597 280.1204172 349.2497696 333.1018466 355.0098883 229.0559561 316.301215 315.836953 287.3847701 292.660436 415.7020063 391.0388427 313.546283 SM-C18:1 22.853841 108.8293385 18.87996283 24.66449088 22.45668023 24.70580601 25.34572395 17.78352637 22.42871347 27.83658183 18.86938417 89.84234901 21.97479934 89.76589919 29.33123342 24.05862778 28.02856629 30.69628481 24.1216307 26.27854248 28.0718541 24.98846987 27.2636977 22.51036724 23.34110142 21.60319101 27.01049905 63.87661599 32.33207817 33.19690179 27.54792247 37.29557112 34.07333252 33.49342104 29.90612603 32.91112546 33.7089969 18.16271948 26.64148149 61.56981282 50.70100381 67.00009665 58.82315715 63.39513039 48.23480598 61.8041113 50.33306938 71.6060248 64.63054978 49.56889943 45.45844187 46.06011641 40.75137352 48.10765954 50.82905106 49.76803802 65.81606018 47.5833484 73.82084856 50.83394063 108.0412452 48.10898085 46.69049188 44.51053022 58.37726236 48.17259918 46.92413882 48.39552404 47.55172072 46.02190126 67.89347557 45.82157843 47.4439704 43.77512198 36.51937866 44.9534927 48.67353436 43.59311009 SM-C20:0 1070.504763 911.6988105 749.9357653 938.3082309 680.3299108 845.1154056 1194.933128 1262.923072 1127.404406 1302.52029 953.2264028 816.9891637 875.2371484 814.9778133 903.8299115 778.092961 1008.294337 896.5637768 712.7549928 824.3975402 1550.049497 1172.010291 870.6323621 1170.738182 1306.327021 1220.458446 1714.41677 587.9184269 1763.66666 1139.078229 1391.388044 1526.013245 1377.88921 1242.136399 861.4952033 894.2674271 1270.014959 1105.871725 1371.660269 2307.584835 1518.170469 1838.095017 2125.985631 1556.666101 1951.328185 1727.517651 1864.490651 1874.606038 1464.348517 1432.079527 1027.055179 1224.716777 1071.111296 1134.1042 878.5428039 1166.335816 1987.040418 1554.768808 1251.527739 2579.451438 3005.544541 2306.664276 2206.426466 2459.439384 1800.904225 2540.876525 1704.503256 2226.90672 1989.604088 2012.989655 761.3981003 1943.715286 1547.044191 1649.390182 1447.434044 1763.236258 1911.009058 1414.067132 SM-C22:0 9997.903548 3345.106175 6742.111219 9349.138666 6059.01237 6956.011048 10248.28025 10640.8787 9421.268814 10514.18531 8251.203795 3957.447141 7847.553579 3499.814765 5917.947672 5707.204629 7827.031037 7186.048636 4857.291778 7087.797601 10332.77261 8835.953119 8434.441736 8449.264918 9027.976804 8414.293362 10051.75649 3995.830693 10657.18885 7925.422297 7709.949209 8220.361726 8128.621368 6941.444913 4542.78842 5101.477471 8092.819397 7818.63127 8614.905164 11724.01471 7605.449496 9801.4415 10961.59321 8486.780482 10511.97933 9163.065713 8346.765778 11241.82913 8539.729008 11612.6194 6277.619148 7928.760238 6262.601024 6636.778811 4114.626095 7590.571182 10335.99446 11756.94055 8389.554427 12135.55999 9466.400466 11259.64584 9821.528852 10251.42249 8297.398165 10713.59299 10366.93985 10859.72859 10754.42431 8635.106322 3984.08356 8657.659211 9812.46839 10786.86301 9683.470169 9511.020123 11088.56207 9889.374036 SM-C22:1 716.477733 243.2980239 468.1545031 547.2204972 310.3801024 489.0246327 836.384256 842.4451281 708.7394816 835.6119154 486.0249858 327.2219636 495.6720059 265.9323583 299.1223134 320.1702476 348.8061072 452.5818304 186.3004598 377.4387762 1220.812077 833.0036616 733.6194497 818.1234981 974.8268304 809.6722988 1107.307671 343.9169661 1154.47678 523.0330031 634.0559671 724.598966 788.3570672 621.001883 393.8077608 380.6673598 638.8547857 641.1429901 840.5642387 1131.198432 516.1084145 802.1198157 998.2313391 629.3892623 902.5582416 778.6678802 667.4511861 949.7348226 625.5325451 890.7343549 347.4057355 468.7458903 388.1005197 435.1451805 218.4955542 464.2345168 837.91185 1023.319128 407.8777642 1510.587809 964.1433866 1362.174296 1157.956743 1244.493165 829.4779357 1312.230882 1198.353921 1374.767175 1111.477616 822.0223224 219.5088418 924.6168618 958.4544206 1150.665521 837.946629 937.0551649 1213.138618 982.4685373 SM-C24:0 6783.673027 3215.945008 3118.269055 6054.584436 3077.185908 4866.918513 6608.92141 6610.248825 5812.929727 5880.981461 4511.73282 3868.349031 5127.459808 3293.23433 2839.558159 3002.101806 4114.371021 4146.992931 2089.653706 4001.849578 7150.821628 6851.682632 9608.377828 6118.005199 5465.086903 4783.816886 6911.450029 4125.931598 8078.239879 5116.022942 3640.585476 5749.579718 4899.684486 3520.398337 1617.210225 2393.700512 5043.418141 4238.772634 5377.097733 4601.625063 2762.722658 3855.397381 4652.947293 3008.610553 3430.199665 3568.777487 2675.298211 4631.975397 3302.448822 4799.048092 2289.637035 2900.809612 1810.968865 2150.96202 1196.909887 2790.685071 4768.128858 5009.921321 5928.169911 6114.161451 4277.219963 5456.740992 3229.447675 3565.035271 3575.69231 5321.159785 4063.415834 4696.39932 3600.861206 3004.873756 2591.984388 3418.832432 3726.062966 4209.936588 2471.171027 3061.99949 4308.365569 3356.942235 SM-C24:1 6648.985931 5761.188907 3854.421321 6440.650813 3664.9378 4431.240527 5747.166584 5296.156637 4812.522647 5573.770106 4588.408524 6260.698946 6007.630695 6017.922196 4367.743109 3672.334096 6190.645966 3953.221054 3339.660905 5493.085555 6528.866596 4946.30712 8847.952942 4909.662777 5300.109856 4266.70562 6153.141417 6584.621612 7156.162083 5349.931611 4912.608857 6791.430235 4885.906935 4507.991349 2416.680752 3433.008892 5501.066237 4546.005404 5147.336368 6405.459223 5072.437159 5606.479397 7297.822859 5642.87197 4725.887844 4924.182144 4464.044693 6864.322693 5652.78496 6955.550474 3960.806211 4461.308614 3722.323976 3662.854661 2831.507836 4824.87247 7621.015432 6838.176932 8880.721789 7451.580888 5830.880849 5673.503455 4347.187662 4074.740187 4936.77294 5471.114746 4566.028837 5875.178851 4439.380971 4495.050838 5226.141994 5577.6063 5746.396475 5103.736787 3780.574558 3141.955428 5293.127923 4113.147841 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name KEGG PubChem identifiers Cer 18:1/16:0 C00195 3495 Cer 18:1/18:0 C00195 3495 Cer 18:1/20:0 C00195 3495 Cer 18:1/22:0 C00195 3495 Cer 18:1/22:1 C00195 3495 Cer 18:1/24:0 C00195 3495 Cer 18:1/24:1 C00195 3495 DHCer 18:0/16:0 C12126 14273 DHCer 18:0/18:0 C12126 14273 DHCer 18:0/20:0 C12126 14273 DHCer 18:0/22:0 C12126 14273 DHCer 18:0/24:0 C12126 14273 DHCer 18:0/24:1 C12126 14273 doxCer 18:1/18:0 0 0 doxCer 18:1/20:0 0 0 doxCer 18:1/22:0 0 0 doxCer 18:1/22:1 0 0 doxCer 18:1/24:0 0 0 doxCer 18:1/24:1 0 0 doxDHCer 18:0/18:0 0 0 doxDHCer 18:0/20:0 0 0 doxDHCer 18:0/22:0 0 0 doxDHCer 18:0/22:1 0 0 doxDHCer 18:0/23:0 0 0 doxDHCer 18:0/24:0 0 0 doxDHCer 18:0/24:1 0 0 Gluc/Gal-Cer 18:1/16:0 C01190 4416 Gluc/Gal-Cer 18:1/20:0 C01190 4416 Gluc/Gal-Cer 18:1/22:0 C01190 4416 Gluc/Gal-Cer 18:1/24:0 C01190 4416 Gluc/Gal-Cer 18:1/24:1 C01190 4416 Lact-Cer 18:1/16:0 C01290 4509 Lact-Cer 18:1/22:0 C01290 4509 Lact-Cer 18:1/24:0 C01290 4509 Lact-Cer 18:1/24:1 C01290 4509 SO-C18:1 C00319 3613 SA-C18:0 C00836 4094 doxSA-C18:0 0 0 SM-C14:0 C00550 3831 SM-C16:0 C00550 3831 SM-C18:0 C00550 3831 SM-C18:1 C00550 3831 SM-C20:0 C00550 3831 SM-C22:0 C00550 3831 SM-C22:1 C00550 3831 SM-C24:0 C00550 3831 SM-C24:1 C00550 3831 METABOLITES_END #END