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CHEBI:36714 - 5β-androstane-3α,17β-diol

ChEBI IDCHEBI:36714
ChEBI Name5β-androstane-3α,17β-diol
Stars
ASCII Name5beta-androstane-3alpha,17beta-diol
Last Modified6 October 2021
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+/m1/s1
InChIKeyCBMYJHIOYJEBSB-GCXXXECGSA-N
ChEBI Ontology
Outgoing Relation(s)
5β-androstane-3α,17β-diol (CHEBI:36714) is a androstane-3α,17β-diol (CHEBI:18011)
IUPAC Name 
5β-androstane-3α,17β-diol
Synonyms  Source
3α,17β-dihydroxyetiocholaneNIST Chemistry WebBook
(3α,5β,17β)-androstane-3,17-diolNIST Chemistry WebBook
UniProt Name  Source
5β-androstane-3α,17β-diolUniProt
Registry NumbersSources
Beilstein:2559485Beilstein
CAS:1851-23-6NIST Chemistry WebBook
CAS:1851-23-6ChemIDplus