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CHEBI:79442 - 9-Thiocyanato-androst-4-ene-3,11,17-trione

ChEBI IDCHEBI:79442
ChEBI Name9-Thiocyanato-androst-4-ene-3,11,17-trione
Stars
DownloadsMolfile
FormulaC20H23NO3S
Net Charge0
Average Mass357.475
Monoisotopic Mass357.13986
SMILES[H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1(SC#N)C(=O)C[C@]1(C)C(=O)CC[C@@]21[H]
InChIInChI=1S/C20H23NO3S/c1-18-10-17(24)20(25-11-21)15(14(18)5-6-16(18)23)4-3-12-9-13(22)7-8-19(12,20)2/h9,14-15H,3-8,10H2,1-2H3/t14-,15-,18-,19-,20-/m0/s1
InChIKeyDWIXJBBZGSOVLL-ZESOOZHZSA-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)
9-Thiocyanato-androst-4-ene-3,11,17-trione (CHEBI:79442) has role androgen (CHEBI:50113)
9-Thiocyanato-androst-4-ene-3,11,17-trione (CHEBI:79442) is a 3-hydroxy steroid (CHEBI:36834)
Manual XrefsDatabases
C14917KEGG COMPOUND