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CHEBI:79655 - 17beta-Hydroxy-2alpha-(hydroxymethyl)-17-methyl-5alpha-androstan-3-one

ChEBI IDCHEBI:79655
ChEBI Name17beta-Hydroxy-2alpha-(hydroxymethyl)-17-methyl-5alpha-androstan-3-one
Stars
Last Modified26 April 2017
DownloadsMolfile
FormulaC21H34O3
Net Charge0
Average Mass334.500
Monoisotopic Mass334.25079
SMILES[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@@]4(C)[C@@]3([H])CC[C@]4(C)O)[C@@]1(C)C[C@@H](CO)C(=O)C2
InChIInChI=1S/C21H34O3/c1-19-11-13(12-22)18(23)10-14(19)4-5-15-16(19)6-8-20(2)17(15)7-9-21(20,3)24/h13-17,22,24H,4-12H2,1-3H3/t13-,14-,15+,16-,17-,19-,20-,21-/m0/s1
InChIKeyGGRVPLDBVRRQSR-NWIHUDFTSA-N
ChEBI Ontology
Outgoing Relation(s)
17beta-Hydroxy-2alpha-(hydroxymethyl)-17-methyl-5alpha-androstan-3-one (CHEBI:79655) is a 3-oxo-5α-steroid (CHEBI:13601)
Manual XrefsDatabases
C15137KEGG COMPOUND
Registry NumbersSources
CAS:20592-44-3KEGG COMPOUND