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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
HMDB00322
1159-66-6		 16-Oxoandrostenediol Thumb C19H28O3
304.4238
304.203844762
HMDB00323
1892-22-4		 3-Amino-2-piperidone Thumb C5H10N2O
114.1457
114.079312952
HMDB00324
14167-51-2		 3a,16a-Dihydroxyandrostenone Thumb C19H28O3
304.4238
304.203844762
HMDB00325
73141-47-6		 3-Hydroxysuberic acid Thumb C8H14O5
190.1938
190.084123558
  • Urine
  • Blood
HMDB00326
80434-32-8		 1b,3a,12a-Trihydroxy-5b-cholanoic acid Thumb C24H40O5
408.5714
408.28757439
  • Urine
  • Blood
HMDB00328
5130-29-0		 12-Ketodeoxycholic acid Thumb C24H38O4
390.5561
390.277009704
HMDB00329
90-27-7		 2-Phenylbutyric acid Thumb C10H12O2
164.2011
164.083729628
HMDB00330
129012-50-6		 3a,4b,12a-Trihydroxy-5b-cholanoic acid Thumb C24H40O5
408.5714
408.28757439
HMDB00331
68753-51-5		 3a,7b,12a-Trihydroxyoxocholanyl-Glycine Thumb C26H43NO6
465.6227
465.309038113
HMDB00332
2410-60-8		 18-Oxocortisol Thumb C21H28O6
376.4434
376.188588628
  • Blood
HMDB00333
1131-94-8		 Isohomovanillic acid Thumb C9H10O4
182.1733
182.057908808
HMDB00335
566-76-7		 16a-Hydroxyestrone Thumb C18H22O3
286.3655
286.15689457
  • Blood
HMDB00336
1910-47-0		 (R)-3-Hydroxyisobutyric acid Thumb C4H8O3
104.1045
104.047344122
  • Cerebrospinal Fluid (CSF)
  • Blood
  • Urine
HMDB00337
51267-44-8		 (S)-3,4-Dihydroxybutyric acid Thumb C4H8O4
120.1039
120.042258744
  • Urine
  • Cerebrospinal Fluid (CSF)
  • Blood
HMDB00338
362-05-0		 2-Hydroxyestradiol Thumb C18H24O3
288.3814
288.172544634
  • Urine
HMDB00339
52320-67-9		 2-Methylbutyrylglycine Thumb C7H13NO3
159.183
159.089543287
  • Urine
HMDB00340
171524-64-4		 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid Thumb C24H40O6
424.5708
424.282489012
HMDB00341
5698-50-0		 2-Octenedioic acid Thumb C8H12O4
172.1785
172.073558872
  • Urine
HMDB00343
362-06-1		 2-Hydroxyestrone Thumb C18H22O3
286.3655
286.15689457
  • Blood
  • Urine
HMDB00344
5976-67-0		 2-Methoxyestradiol-3-methylether Thumb C20H28O3
316.4345
316.203844762
HMDB00345
14292-29-6		 3-Hydroxyadipic acid Thumb C6H10O5
162.1406
162.05282343
  • Urine
  • Blood
HMDB00346
29625-79-4		 3-Deoxyarabinohexonic acid Thumb C6H12O6
180.1559
180.063388116
HMDB00347
547-81-9		 16b-Hydroxyestradiol Thumb C18H24O3
288.3814
288.172544634
  • Blood
  • Urine
HMDB00348
2569-04-2		 3b,12a-Dihydroxy-5a-cholanoic acid Thumb C24H40O4
392.572
392.292659768
HMDB00349
17675-99-9		 Erythrono-1,4-lactone Thumb C4H6O4
118.088
118.02660868