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CHEBI:173191 - 16-Oxoandrostenediol

ChEBI IDCHEBI:173191
ChEBI Name16-Oxoandrostenediol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H28O3
Net Charge0
Average Mass304.430
Monoisotopic Mass304.20384
SMILES[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](O)C(=O)C[C@@]21[H]
InChIInChI=1S/C19H28O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h3,12-15,17,20,22H,4-10H2,1-2H3/t12-,13+,14-,15-,17-,18-,19-/m0/s1
InChIKeyAKRBLZKRYPEVIK-PEMPUTJUSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) feces (BTO:0000440) MetaboLights (MTBLS2721)
Roles Classification
Biological Role:
androgen  A sex hormone that stimulates or controls the development and maintenance of masculine characteristics in vertebrates by binding to androgen receptors.
ChEBI Ontology
Outgoing Relation(s)
16-Oxoandrostenediol (CHEBI:173191) has role androgen (CHEBI:50113)
16-Oxoandrostenediol (CHEBI:173191) is a 3-hydroxy steroid (CHEBI:36834)
IUPAC Name 
(3S,8R,9S,10R,13S,14S,17R)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-one
Manual XrefsDatabases
132993ChemSpider
LMST02020088LIPID MAPS
Registry NumbersSources
CAS:1159-66-6ChemIDplus