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CHEBI:79805 - (Z)-11beta,21-Dihydroxypregna-1,4,17(20)-trien-3-one

ChEBI IDCHEBI:79805
ChEBI Name(Z)-11beta,21-Dihydroxypregna-1,4,17(20)-trien-3-one
Stars
DownloadsMolfile
FormulaC21H28O3
Net Charge0
Average Mass328.452
Monoisotopic Mass328.20384
SMILES[H][C@@]12CCC3=CC(=O)C=C[C@]3(C)[C@@]1([H])[C@@H](O)C[C@]1(C)/C(=C\CO)CC[C@@]21[H]
InChIInChI=1S/C21H28O3/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h7-9,11,16-19,22,24H,3-6,10,12H2,1-2H3/b13-8-/t16-,17-,18-,19+,20-,21+/m0/s1
InChIKeyFIMYJWIQTVIDQB-PKJGFKEFSA-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)
(Z)-11beta,21-Dihydroxypregna-1,4,17(20)-trien-3-one (CHEBI:79805) has role androgen (CHEBI:50113)
(Z)-11beta,21-Dihydroxypregna-1,4,17(20)-trien-3-one (CHEBI:79805) is a 3-hydroxy steroid (CHEBI:36834)
Manual XrefsDatabases
C15303KEGG COMPOUND