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Human Metabolome Database Version 3.5

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HMDB IDDouble
CAS Number		 NameDouble Structure FormulaDouble
Average MassDouble
Mono MassDouble 		Biofluid Location
HMDB40386
147395-90-2		 Acrimarine J Thumb C35H33NO8
595.6384
595.220617037
HMDB40387
147395-89-9		 Acrimarine I Thumb C34H31NO7
565.6124
565.210052351
HMDB40388
156162-09-3		 Columbaridione Thumb C20H24O5
344.4016
344.162373878
HMDB40389
156101-09-6		 Erinacine C Thumb C25H38O6
434.5656
434.266838948
HMDB40390
156101-08-5		 Erinacine B Thumb C25H36O6
432.5497
432.251188884
HMDB40391
152218-60-5		 16beta-Hydroxystellatogenin Thumb C30H48O5
488.6991
488.350174646
HMDB40392
110-27-0		 Isopropyl tetradecanoate Thumb C17H34O2
270.4507
270.255880332
HMDB40397
5655-61-8		 (-)-Bornyl acetate Thumb C12H20O2
196.286
196.146329884
HMDB40398
155510-72-8		 1alpha,3beta,22R-Trihydroxyergosta-5,24E-dien-26-oic acid 3-O-b-D-glucoside 26-O-b-D-glucosyl ester Thumb C40H64O15
784.9272
784.424521378
HMDB40399
155510-73-9		 1alpha,3beta,22R-Trihydroxyergosta-5,24E-dien-26-oic acid 3-O-b-D-glucoside 26-O-[b-D-glucosyl-(1->2)-b-D-glucosyl] ester Thumb C46H74O20
947.0678
946.477344808
HMDB40400
155510-74-0		 1alpha,3beta,22R-Trihydroxyergosta-5,24E-dien-26-oic acid 3-O-b-D-glucoside 26-O-[b-D-glucosyl-(1->2)-6-acetyl-b-D-glucosyl] ester Thumb C48H76O21
989.1044
988.487909494
HMDB40401
155520-07-3		 1alpha,3beta,22R-Trihydroxyergosta-5,24E-dien-26-oic acid 3-O-b-D-glucoside 26-O-[b-D-glucosyl-(1->4)-b-D-glucosyl-(1->2)-6-acetyl-b-D-glucosyl] ester Thumb C54H86O26
1151.245
1150.540732924
HMDB40402
155520-08-4		 1alpha,3beta,22R-Trihydroxyergosta-5,24E-dien-26-oic acid 3-O-b-D-glucoside 26-O-[b-D-glucosyl-(1->4)-6-acetyl-b-D-glucosyl-(1->2)-6-acetyl-b-D-glucosyl] ester Thumb C56H88O27
1193.2817
1192.55129761
HMDB40403
151194-18-2		 22R-Acetoxy-1alpha,3beta-dihydroxyergosta-5,24E-dien-26-oic acid 3-O-b-D-glucoside 26-O-[b-D-glucosyl-(1->4)-b-D-glucosyl-(1->2)-6-acetyl-b-D-glucosyl] ester Thumb C56H88O27
1193.2817
1192.55129761
HMDB40404
151194-19-3		 22R-Acetoxy-1alpha,3beta-dihydroxyergosta-5,24E-dien-26-oic acid 3-O-b-D-glucoside 26-O-[b-D-glucosyl-(1->4)-6-acetyl-b-D-glucosyl-(1->2)-6-acetyl-b-D-glucosyl] ester Thumb C58H90O28
1235.3184
1234.561862296
HMDB40405
155510-75-1		 26-Glucosyl-1,3,11,22-tetrahydroxyergosta-5,24-dien-26-oate Thumb C34H54O11
638.786
638.36661257
HMDB40406
155510-76-2		 26-(2-Glucosyl-6-acetylglucosyl]-1,3,11,22-tetrahydroxyergosta-5,24-dien-26-oate Thumb C42H66O17
842.9632
842.430000686
HMDB40407
94356-37-3		 (S)-2,3-Dihydro-7-hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-acetic acid Thumb C12H12O5
236.2207
236.068473494
HMDB40408
94356-34-0		 7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-acetic acid Thumb C12H10O5
234.2048
234.05282343
HMDB40409
35608-64-1		 Ethyl (±)-3-hydroxybutyrate Thumb C6H12O3
132.1577
132.07864425
HMDB40410
5466-06-8		 Ethyl 3-mercaptopropanoic acid Thumb C5H10O2S
134.197
134.040150254
HMDB40411
2021-28-5		 Ethyl 3-phenylpropanoate Thumb C11H14O2
178.2277
178.099379692
HMDB40412
19224-26-1		 DL-Propylene glycol dibenzoate Thumb C17H16O4
284.3065
284.104859
HMDB40413
13327-56-5		 Ethyl 3-(methylthio)propanoate Thumb C6H12O2S
148.223
148.055800318
HMDB40414
155062-80-9		 (3beta,24(241)Z)-24-Ethylidenelanost-9(11)-en-3-ol Thumb C32H54O
454.7706
454.41746635