Drug Information

Drug General Information
Drug ID
DXX1AB
Drug Name
17-tert-Butylcarbamoyl-13-methyl-7,8,9,11,12,13,14,15-octahydro-6H-cyclopenta[a]phenanthrene-3-carboxylic acid
Synonyms
CHEMBL368288
Indication Discovery agent Investigative [1587926]
Formula
C24H31NO3
Canonical SMILES
CC(C)(C)NC(=O)C1=CCC2C3CCc4cc(ccc4C3CC[C@]12C)C(=O)O
InChI
InChI=1S/C24H31NO3/c1-23(2,3)25-21(26)20-10-9-19-18-8-5-14-13-15(22(27)28)6-7-16(14)17(18)11-12-24(19,20)4/h6-7,10,13,17-19H,5,8-9,11-12H2,1-4H3,(H,25,26)(H,27,28)/t17?,18?,19?,24-/m0/s1
InChIKey
ZDRGLSBALZDWBH-MPEHDAKKSA-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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