Drug Information

Drug General Information
Drug ID
DX1CDR
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-methoxy-phenyl)-amide
Synonyms
CHEMBL108305
Indication Discovery agent Investigative [1587926]
Formula
C26H34N2O3
Canonical SMILES
COc1ccccc1NC(=O)C2CCC3C4CCC5NC(=O)C=C[C@]5(C)C4CC[C@]23C
InChI
InChI=1S/C26H34N2O3/c1-25-14-12-18-16(8-11-22-26(18,2)15-13-23(29)28-22)17(25)9-10-19(25)24(30)27-20-6-4-5-7-21(20)31-3/h4-7,13,15-19,22H,8-12,14H2,1-3H3,(H,27,30)(H,28,29)/t16?,17?,18?,19?,22?,25-,26+/m0/s1
InChIKey
FFFBLUYUGVALAT-IGASQWQDSA-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

If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.