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CHEBI:86393 - (5α)-androst-3-en-17-one

ChEBI IDCHEBI:86393
ChEBI Name(5α)-androst-3-en-17-one
Stars
ASCII Name(5alpha)-androst-3-en-17-one
DefinitionAn androstanoid that is (5α)-androst-3-ene substituted by an oxo group at position 5.
Last Modified13 November 2018
Submitternamrata
DownloadsMolfile
FormulaC19H28O
Net Charge0
Average Mass272.432
Monoisotopic Mass272.21402
SMILES[H][C@@]12CC[C@@]3([H])C=CCC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(=O)CC[C@@]21[H]
InChIInChI=1S/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3,5,13-16H,4,6-12H2,1-2H3/t13-,14+,15+,16+,18+,19+/m1/s1
InChIKeyRJWNCDOWHNLVPF-HKQXQEGQSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (25502724)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
(5α)-androst-3-en-17-one (CHEBI:86393) has role human metabolite (CHEBI:77746)
(5α)-androst-3-en-17-one (CHEBI:86393) is a 17-oxo steroid (CHEBI:19168)
(5α)-androst-3-en-17-one (CHEBI:86393) is a androstanoid (CHEBI:50402)
IUPAC Name 
(5α)-androst-3-en-17-one
Manual XrefsDatabases
HMDB0006046HMDB
Citations