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CHEBI:86377 - 5β-dihydroepitestosterone

ChEBI IDCHEBI:86377
ChEBI Name5β-dihydroepitestosterone
Stars
ASCII Name5beta-dihydroepitestosterone
DefinitionAn androstanoid with a 5β-configuration formed by reduction across the C4-C5 double bond of epitestosterone.
Last Modified26 April 2017
Submitternhn
DownloadsMolfile
FormulaC19H30O2
Net Charge0
Average Mass290.447
Monoisotopic Mass290.22458
SMILES[H][C@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@H](O)CC[C@@]34[H])[C@@]1(C)CCC(=O)C2
InChIInChI=1S/C19H30O2/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/h12,14-17,21H,3-11H2,1-2H3/t12-,14+,15+,16+,17-,18+,19+/m1/s1
InChIKeyNVKAWKQGWWIWPM-BNFYIPGJSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (21255593)
Roles Classification
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
5β-dihydroepitestosterone (CHEBI:86377) has role human xenobiotic metabolite (CHEBI:76967)
5β-dihydroepitestosterone (CHEBI:86377) is a 17α-hydroxy steroid (CHEBI:35342)
5β-dihydroepitestosterone (CHEBI:86377) is a 3-oxo-5β-steroid (CHEBI:1624)
5β-dihydroepitestosterone (CHEBI:86377) is a androstanoid (CHEBI:50402)
IUPAC Name 
(5β,17α)-17-hydroxyandrostan-3-one
Synonym  Source
(5β)-17α-hydroxyandrostan-3-oneChEBI
UniProt Name  Source
5β-dihydroepitestosteroneUniProt
Registry NumbersSources
Reaxys:3120177Reaxys
Citations