Drug Information

Drug General Information
Drug ID
DXMP8N
Drug Name
(4aR,6aS)-4a,6a-Dimethyl-2-oxo-2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-1H-indeno[5,4-f]quinoline-7-carboxylic acid (3-trifluoromethyl-phenyl)-amide
Synonyms
CHEMBL432439
Indication Discovery agent Investigative [1587926]
Formula
C26H31F3N2O2
Canonical SMILES
C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc5cccc(c5)C(F)(F)F
InChI
InChI=1S/C26H31F3N2O2/c1-24-12-10-19-17(6-9-21-25(19,2)13-11-22(32)31-21)18(24)7-8-20(24)23(33)30-16-5-3-4-15(14-16)26(27,28)29/h3-5,11,13-14,17-21H,6-10,12H2,1-2H3,(H,30,33)(H,31,32)/t17?,18?,19?,20?,21?,24-,25+/m0/s1
InChIKey
BFRVODSGJAPDMQ-GXSBFMHBSA-N
Target and Pathway
Target(s) 3-oxo-5-alpha-steroid 4-dehydrogenase 1 Target Info [1587926]
3-oxo-5-alpha-steroid 4-dehydrogenase 2 Target Info [1587926]
BioCyc Pathway Superpathway of steroid hormone biosynthesis
Allopregnanolone biosynthesis
Androgen biosynthesisPWY-7305:Superpathway of steroid hormone biosynthesis
Androgen biosynthesis
KEGG Pathway Steroid hormone biosynthesishsa00140:Steroid hormone biosynthesis
Prostate cancer
NetPath Pathway IL2 Signaling Pathway
PathWhiz Pathway Androgen and Estrogen Metabolism
Reactome Androgen biosynthesisR-HSA-193048:Androgen biosynthesis
References
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017

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