EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:183809 - 7β-hydroxyepiandrosterone

Default Structure
ChEBI IDCHEBI:183809
ChEBI Name7β-hydroxyepiandrosterone
Stars
ASCII Name7beta-hydroxyepiandrosterone
DefinitionA 3β-hydroxy steroid that is epiandrosterone carrying a hydroxy group at the 7β position. It is an endogenous androgen metabolite that has been shown to exert neuroprotective effects.
Last Modified18 November 2021
Submitterlaimo
DownloadsMolfile
FormulaC19H30O3
Net Charge0
Average Mass306.446
Monoisotopic Mass306.21949
SMILES[H][C@]12C[C@@H](O)CC[C@]1(C)[C@@]1([H])CC[C@]3(C)C(=O)CC[C@@]3([H])[C@]1([H])[C@@H](O)C2
InChIInChI=1S/C19H30O3/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/h11-15,17,20-21H,3-10H2,1-2H3/t11-,12+,13+,14+,15+,17+,18+,19+/m1/s1
InChIKeyVFPMCLQMAUVEHD-UCPSWNCLSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) PubMed (30484677)
Roles Classification
Biological Roles:
androgen  A sex hormone that stimulates or controls the development and maintenance of masculine characteristics in vertebrates by binding to androgen receptors.
estrogen receptor antagonist  An antagonist at the estrogen receptor.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Applications:
neuroprotective agent  Any compound that can be used for the treatment of neurodegenerative disorders.
estrogen receptor antagonist  An antagonist at the estrogen receptor.
ChEBI Ontology
Outgoing Relation(s)
7β-hydroxyepiandrosterone (CHEBI:183809) has functional parent epiandrosterone (CHEBI:541975)
7β-hydroxyepiandrosterone (CHEBI:183809) has role androgen (CHEBI:50113)
7β-hydroxyepiandrosterone (CHEBI:183809) has role estrogen receptor antagonist (CHEBI:50792)
7β-hydroxyepiandrosterone (CHEBI:183809) has role human metabolite (CHEBI:77746)
7β-hydroxyepiandrosterone (CHEBI:183809) has role neuroprotective agent (CHEBI:63726)
7β-hydroxyepiandrosterone (CHEBI:183809) is a 17-oxo steroid (CHEBI:19168)
7β-hydroxyepiandrosterone (CHEBI:183809) is a 3β-hydroxy steroid (CHEBI:36836)
7β-hydroxyepiandrosterone (CHEBI:183809) is a 7β-hydroxy steroid (CHEBI:35349)
7β-hydroxyepiandrosterone (CHEBI:183809) is a androstanoid (CHEBI:50402)
IUPAC Name 
3β,7β-dihydroxy-5α-androstan-17-one
Synonyms  Source
(3β,5α,7β)-3,7-dihydroxyandrostan-17-oneChemIDplus
7-beta-hydroxyepiandrosteroneChemIDplus
7β-hydroxy-epiandrosteroneChEBI
7β-OH-EPIAChemIDplus
HF-0220ChemIDplus
HF0220DrugBank
UniProt Name  Source
3β,7β-dihydroxy-5α-androstan-17-oneUniProt
Manual XrefsDatabases
7%CE%B2-HydroxyepiandrosteroneWikipedia
8011902ChemSpider
DB06622DrugBank
HMDB0259631HMDB
Registry NumbersSources
CAS:25848-69-5ChemIDplus
Citations