Drug General Information
Drug ID
DXEM0M
Drug Name
(17-Diisopropylcarbamoyl-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-ylmethyl)-phosphonic acid
Synonyms
CHEMBL1628067
Indication Discovery agent Investigative [1587926]
Formula
C26H40NO4P
Canonical SMILES
CC(C)N(C(C)C)C(=O)[C@H]1CC[C@H]2[C@@H]3CCc4cc(CP(=O)(O)O)ccc4[C@H]3CC[C@]12C
InChI
InChI=1S/C26H40NO4P/c1-16(2)27(17(3)4)25(28)24-11-10-23-22-9-7-19-14-18(15-32(29,30)31)6-8-20(19)21(22)12-13-26(23,24)5/h6,8,14,16-17,21-24H,7,9-13,15H2,1-5H3,(H2,29,30,31)/t21-,22-,23+,24-,26+/m1/s1
InChIKey
PQHLUSICXULINZ-XCVFGXLCSA-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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