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CHEBI:11909 - 3β-hydroxy-5α-pregnan-20-one

ChEBI IDCHEBI:11909
ChEBI Name3β-hydroxy-5α-pregnan-20-one
Stars
ASCII Name3beta-hydroxy-5alpha-pregnan-20-one
Last Modified18 October 2017
DownloadsMolfile
FormulaC21H34O2
Net Charge0
Average Mass318.501
Monoisotopic Mass318.25588
SMILES[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])C(C)=O)[C@@]1(C)CC[C@H](O)C2
InChIInChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3/t14-,15-,16-,17+,18-,19-,20-,21+/m0/s1
InChIKeyAURFZBICLPNKBZ-FZCSVUEKSA-N
ChEBI Ontology
Outgoing Relation(s)
3β-hydroxy-5α-pregnan-20-one (CHEBI:11909) is a 3-hydroxy-5α-pregnan-20-one (CHEBI:50170)
IUPAC Name 
3β-hydroxy-5α-pregnan-20-one
Synonyms  Source
allopregnan-3β-ol-20-oneChemIDplus
5α-pregnan-3β-ol-20-oneNIST Chemistry WebBook
(3β,5α)-3-hydroxypregnan-20-oneNIST Chemistry WebBook
3beta-Hydroxy-5alpha-pregnane-20-oneKEGG COMPOUND
UniProt Name  Source
3β-hydroxy-5α-pregnane-20-oneUniProt
Manual XrefsDatabases
C15484KEGG COMPOUND
Registry NumbersSources
Beilstein:2219963Beilstein
CAS:516-55-2ChemIDplus
CAS:516-55-2NIST Chemistry WebBook
CAS:516-55-2KEGG COMPOUND