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CHEBI:27727 - androstane-3,17-diol

ChEBI IDCHEBI:27727
ChEBI Nameandrostane-3,17-diol
Stars
Secondary ChEBI IDsCHEBI:2713, CHEBI:22544
Last Modified3 August 2014
DownloadsMolfile
FormulaC19H32O2
Net Charge0
Average Mass292.463
Monoisotopic Mass292.24023
SMILES[H][C@@]12CCC3CC(O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(O)CC[C@@]21[H]
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-CAHXEBCQSA-N
ChEBI Ontology
Outgoing Relation(s)
androstane-3,17-diol (CHEBI:27727) is a 17-hydroxy steroid (CHEBI:36838)
androstane-3,17-diol (CHEBI:27727) is a 3-hydroxy steroid (CHEBI:36834)
androstane-3,17-diol (CHEBI:27727) is a androstanoid (CHEBI:50402)
Incoming Relation(s)
5beta-androstane-3beta,17alpha-diol (CHEBI:746890) is a androstane-3,17-diol (CHEBI:27727)
5α-androstane-3β,17α-diol (CHEBI:40836) is a androstane-3,17-diol (CHEBI:27727)
5α-androstane-3β,17β-diol (CHEBI:18329) is a androstane-3,17-diol (CHEBI:27727)
5β-androstane-3β,17β-diol (CHEBI:36715) is a androstane-3,17-diol (CHEBI:27727)
androstane-3α,17β-diol (CHEBI:18011) is a androstane-3,17-diol (CHEBI:27727)
IUPAC Name 
androstane-3,17-diol
Synonyms  Source
Androstane-3,17-diolKEGG COMPOUND
AndrostanediolKEGG COMPOUND
Manual XrefsDatabases
C07632KEGG COMPOUND
Registry NumbersSources
Beilstein:9220448Beilstein
CAS:25126-76-5KEGG COMPOUND
CAS:25126-76-5ChemIDplus