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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
HMDB03661
14475-60-6		 N-Methylputrescine Thumb C5H14N2
102.1781
102.115698458
HMDB03665
 Phosphoribosyl-ATP Thumb C15H26N5O20P4
720.2835
720.012159345
HMDB03667
1686-14-2		 Alpha-Pinene-oxide Thumb C10H16O
152.2334
152.120115134
HMDB03671
110-43-0		 2-Heptanone Thumb C7H14O
114.1855
114.10446507
  • Cerebrospinal Fluid (CSF)
  • Urine
HMDB03681
3025-96-5		 4-Acetamidobutanoic acid Thumb C6H11NO3
145.1564
145.073893223
  • Blood
  • Urine
HMDB03689
 Neuroprotectin D1 Thumb C22H32O4
360.4871
360.230059512
HMDB03701
582-60-5		 Dimethylbenzimidazole Thumb C9H10N2
146.1891
146.08439833
  • Prostate Tissue
HMDB03705
5115-19-5		 Phosphoguanidinoacetate Thumb C3H8N3O5P
197.0865
197.020156893
HMDB03712
1066-12-2		 (2E)-Dodecenoyl-CoA Thumb C33H52N7O17P3S
943.789
943.235323499
HMDB03733
 Resolvin D1 Thumb C22H32O5
376.4865
376.224974134
  • Blood
HMDB03745
3375-50-6		 Mesna Thumb C2H6O3S2
142.197
141.975835438
HMDB03747
501-36-0		 Resveratrol Thumb C14H12O3
228.2433
228.07864425
  • Urine
HMDB03752
22248-63-1		 LysoPC(10:0) Thumb C18H39NO7P
412.4785
412.246414119
HMDB03759
566-65-4		 5a-Pregnane-3,20-dione Thumb C21H32O2
316.4776
316.240230268
  • Blood
HMDB03764
21064-18-6		 Glutamylalanine Thumb C8H14N2O5
218.2072
218.090271568
HMDB03767
7339-87-9		 4-Hydroxyphenylacetaldehyde Thumb C8H8O2
136.1479
136.0524295
HMDB03769
1229-12-5		 Etiocholanedione Thumb C19H28O2
288.4244
288.20893014
HMDB03771
2382-59-4		 2-Methylacetoacetic acid Thumb C5H8O3
116.1152
116.047344122
  • Urine
  • Blood
HMDB03791
5707-55-1		 3,4-Dihydroxyphenylacetaldehyde Thumb C8H8O3
152.1473
152.047344122
HMDB03797
2540-56-9		 Bovinic acid Thumb C18H32O2
280.4455
280.240230268
  • Blood
HMDB03818
521-17-5		 5-Androstenediol Thumb C19H30O2
290.4403
290.224580204
HMDB03822
604-35-3		 Cholesteryl acetate Thumb C29H48O2
428.6902
428.36543078
HMDB03826
5118-16-1		 6,7-Dimethyl-8-(1-D-ribityl)lumazine Thumb C13H18N4O6
326.3052
326.122634328
HMDB03828
16816-67-4		 D-Pantethine Thumb C22H42N4O8S2
554.721
554.24440572
HMDB03831
 Beta-Tyrosine Thumb C9H11NO3
181.1885
181.073893223