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CHEBI:177536 - Galeterone

ChEBI IDCHEBI:177536
ChEBI NameGaleterone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H32N2O
Net Charge0
Average Mass388.555
Monoisotopic Mass388.25146
SMILES[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(n3cnc4ccccc43)=CC[C@@]21[H]
InChIInChI=1S/C26H32N2O/c1-25-13-11-18(29)15-17(25)7-8-19-20-9-10-24(26(20,2)14-12-21(19)25)28-16-27-22-5-3-4-6-23(22)28/h3-7,10,16,18-21,29H,8-9,11-15H2,1-2H3/t18-,19-,20-,21-,25-,26-/m0/s1
InChIKeyPAFKTGFSEFKSQG-PAASFTFBSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
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)
Galeterone (CHEBI:177536) has role androgen (CHEBI:50113)
Galeterone (CHEBI:177536) is a 3-hydroxy steroid (CHEBI:36834)
IUPAC Name 
(3S,8R,9S,10R,13S,14S)-17-(benzimidazol-1-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Manual XrefsDatabases
9363493ChemSpider
D10125KEGG DRUG
DB12415DrugBank
TOKPDBeChem
Registry NumbersSources
CAS:851983-85-2ChemIDplus