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CHEBI:79834 - 3β-hydroxy-5α-androstane-7,17-dione

ChEBI IDCHEBI:79834
ChEBI Name3β-hydroxy-5α-androstane-7,17-dione
Stars
ASCII Name3beta-hydroxy-5alpha-androstane-7,17-dione
DefinitionAn androstanoid that is epiandrosterone substituted by an oxo group at position 7.
Last Modified16 November 2021
DownloadsMolfile
FormulaC19H28O3
Net Charge0
Average Mass304.430
Monoisotopic Mass304.20384
SMILES[H][C@@]12CC(=O)[C@@]3([H])[C@]4([H])CCC(=O)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CC[C@H](O)C2
InChIInChI=1S/C19H28O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h11-14,17,20H,3-10H2,1-2H3/t11-,12+,13+,14+,17+,18+,19+/m1/s1
InChIKeyONVVZSHYQMOXLN-ZVMDJWLLSA-N
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)
3β-hydroxy-5α-androstane-7,17-dione (CHEBI:79834) has functional parent epiandrosterone (CHEBI:541975)
3β-hydroxy-5α-androstane-7,17-dione (CHEBI:79834) has role androgen (CHEBI:50113)
3β-hydroxy-5α-androstane-7,17-dione (CHEBI:79834) is a 17-oxo steroid (CHEBI:19168)
3β-hydroxy-5α-androstane-7,17-dione (CHEBI:79834) is a 3β-hydroxy steroid (CHEBI:36836)
3β-hydroxy-5α-androstane-7,17-dione (CHEBI:79834) is a 7-oxo steroid (CHEBI:47789)
3β-hydroxy-5α-androstane-7,17-dione (CHEBI:79834) is a androstanoid (CHEBI:50402)
IUPAC Name 
3β-hydroxy-5α-androstane-7,17-dione
Synonyms  Source
(3aS,3bR,5aR,7S,9aS,9bS,11aS)-7-hydroxy-9a,11a-dimethyltetradecahydro-1H-cyclopenta[a]phenanthrene-1,4(3bH)-dioneIUPAC
(3β,5α)-3-hydroxy-androstane-7,17-dioneChemIDplus
5α-androstan-3β-ol-7,17-dioneChEBI
UniProt Name  Source
3β-hydroxy-5α-androstane-7,17-dioneUniProt
Manual XrefsDatabases
C15332KEGG COMPOUND
Registry NumbersSources
CAS:49643-99-4ChemIDplus