Drug Information

Drug General Information
Drug ID
DX4ANH
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 (2,6-dimethyl-phenyl)-amide
Synonyms
CHEMBL108181
Indication Discovery agent Investigative [1587926]
Formula
C27H36N2O2
Canonical SMILES
Cc1cccc(C)c1NC(=O)C2CCC3C4CCC5NC(=O)C=C[C@]5(C)C4CC[C@]23C
InChI
InChI=1S/C27H36N2O2/c1-16-6-5-7-17(2)24(16)29-25(31)21-10-9-19-18-8-11-22-27(4,15-13-23(30)28-22)20(18)12-14-26(19,21)3/h5-7,13,15,18-22H,8-12,14H2,1-4H3,(H,28,30)(H,29,31)/t18?,19?,20?,21?,22?,26-,27+/m0/s1
InChIKey
QAHXIOGYJOSPBU-JDNVPULCSA-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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