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CHEBI:2150 - 5β-dihydrotestosterone

ChEBI IDCHEBI:2150
ChEBI Name5β-dihydrotestosterone
Stars
ASCII Name5beta-dihydrotestosterone
DefinitionA 17β-hydroxyandrostan-3-one that has β- configuration at position 5. It is a metabolite of testosterone.
Last Modified22 August 2017
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-MISPCMORSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
androgen  A sex hormone that stimulates or controls the development and maintenance of masculine characteristics in vertebrates by binding to androgen receptors.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Application:
vasodilator agent  A drug used to cause dilation of the blood vessels.
ChEBI Ontology
Outgoing Relation(s)
5β-dihydrotestosterone (CHEBI:2150) has role androgen (CHEBI:50113)
5β-dihydrotestosterone (CHEBI:2150) has role human metabolite (CHEBI:77746)
5β-dihydrotestosterone (CHEBI:2150) has role mouse metabolite (CHEBI:75771)
5β-dihydrotestosterone (CHEBI:2150) has role vasodilator agent (CHEBI:35620)
5β-dihydrotestosterone (CHEBI:2150) is a 17β-hydroxyandrostan-3-one (CHEBI:85278)
5β-dihydrotestosterone (CHEBI:2150) is a 3-oxo-5β-steroid (CHEBI:1624)
IUPAC Name 
17β-hydroxy-5βandrostan-3-one
Synonyms  Source
(5β,17β)-17-hydroxyandrostan-3-oneIUPAC
(5β,8α,17β)-17-hydroxyandrostan-3-onePDBeChem
5β-androstan-17β-ol-3-oneChemIDplus
etiocholan-17-beta-ol-3-oneChemIDplus
5β,17β-hydroxyandrostan-3-oneChemIDplus
5-beta-DHTChemIDplus
UniProt Name  Source
5β-dihydrotestosteroneUniProt
Manual XrefsDatabases
C05293KEGG COMPOUND
BDTPDBeChem
LMST02020069LIPID MAPS
HMDB0006770HMDB
DB07447DrugBank
Registry NumbersSources
Reaxys:2334616Reaxys
CAS:571-22-2KEGG COMPOUND
CAS:571-22-2ChemIDplus
Citations