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CHEBI:40836 - 5α-androstane-3β,17α-diol

ChEBI IDCHEBI:40836
ChEBI Name5α-androstane-3β,17α-diol
Stars
ASCII Name5alpha-androstane-3beta,17alpha-diol
Secondary ChEBI IDsCHEBI:36694, CHEBI:40832
Last Modified22 August 2016
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC19H32O2
Net Charge0
Average Mass292.463
Monoisotopic Mass292.24023
SMILES[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@H](O)CC[C@@]34[H])[C@@]1(C)CC[C@H](O)C2
InChIInChI=1S/C19H32O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-17,20-21H,3-11H2,1-2H3/t12-,13-,14-,15-,16-,17+,18-,19-/m0/s1
InChIKeyCBMYJHIOYJEBSB-MFXFBURESA-N
ChEBI Ontology
Outgoing Relation(s)
5α-androstane-3β,17α-diol (CHEBI:40836) is a 17α-hydroxy steroid (CHEBI:35342)
5α-androstane-3β,17α-diol (CHEBI:40836) is a 3β-hydroxy steroid (CHEBI:36836)
5α-androstane-3β,17α-diol (CHEBI:40836) is a androstane-3,17-diol (CHEBI:27727)
Incoming Relation(s)
5α-androstane-3β,17α-diol disulfate (CHEBI:133112) has functional parent 5α-androstane-3β,17α-diol (CHEBI:40836)
IUPAC Name 
5α-androstane-3β,17α-diol
Synonym  Source
5-ALPHA-ANDROSTANE-3-BETA,17-ALPHA-DIOLPDBeChem
Manual XrefsDatabases
AONPDBeChem
DB03926DrugBank
Registry NumbersSources
Beilstein:2559487Beilstein