Drug Information

Drug General Information
Drug ID
DX3GJO
Drug Name
(10R,13S)-17-Diisopropylcarbamoyl-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid
Synonyms
CHEMBL24091
Indication Discovery agent Investigative [1587926]
Formula
C27H39NO3
Canonical SMILES
CC(C)N(C(C)C)C(=O)C1=CCC2C3CCC4=CC(=CC[C@]4(C)C3CC[C@]12C)C(=O)O
InChI
InChI=1S/C27H39NO3/c1-16(2)28(17(3)4)24(29)23-10-9-21-20-8-7-19-15-18(25(30)31)11-13-26(19,5)22(20)12-14-27(21,23)6/h10-11,15-17,20-22H,7-9,12-14H2,1-6H3,(H,30,31)/t20?,21?,22?,26-,27-/m0/s1
InChIKey
LGKMEHLZMDCMTK-HDYFOKATSA-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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