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CHEBI:229004 - 3alpha,17alpha-Dihydroxy-5beta-androstane

ChEBI IDCHEBI:229004
ChEBI Name3alpha,17alpha-Dihydroxy-5beta-androstane
Stars
SubmitterMetaboLights
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-ULTMTAQRSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
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)
3alpha,17alpha-Dihydroxy-5beta-androstane (CHEBI:229004) has role androgen (CHEBI:50113)
3alpha,17alpha-Dihydroxy-5beta-androstane (CHEBI:229004) is a 3-hydroxy steroid (CHEBI:36834)
IUPAC Name 
(3R,5R,8R,9S,10S,13S,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
Manual XrefsDatabases
8141469ChemSpider
LMST02020093LIPID MAPS