Drug Information

Drug General Information
Drug ID
DX1QO2
Drug Name
(S)-4-{1-[1-((S)-1-(S)-Carboxy-2-hydroxy-ethylcarbamoyl)-3-methyl-butylcarbamoyl]-2-methyl-propylcarbamoyl}-2-((2E,6E)-3,7,11-trimethyl-dodeca-2,6,10-trienylcarbamoyl)-butyric acid
Synonyms
CHEMBL68233
Indication Discovery agent Investigative [1587926]
Formula
C35H58N4O9
Canonical SMILES
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)CCC(C(=O)O)C(=O)NC\\C=C(/C)\\CC\\C=C(/C)\\CCC=C(C)C)C(C)C)C(=O)N[C@@H](CO)C(=O)O
InChI
InChI=1S/C35H58N4O9/c1-21(2)11-9-12-24(7)13-10-14-25(8)17-18-36-31(42)26(34(45)46)15-16-29(41)39-30(23(5)6)33(44)37-27(19-22(3)4)32(43)38-28(20-40)35(47)48/h11,13,17,22-23,26-28,30,40H,9-10,12,14-16,18-20H2,1-8H3,(H,36,42)(H,37,44)(H,38,43)(H,39,41)(H,45,46)(H,47,48)/b24-13+,25-17+/t26?,27-,28-,30-/m0/s1
InChIKey
JILXFUQMUGLWJK-WJFISNTOSA-N
Target and Pathway
Target(s) Farnesyltransferase Target Info [1587926]
Protein farnesyltransferase beta subunit Target Info [1587926]
KEGG Pathway Terpenoid backbone biosynthesis
Biosynthesis of antibioticshsa00900:Terpenoid backbone biosynthesis
Biosynthesis of antibiotics
NetPath Pathway TSH Signaling Pathway
Reactome Apoptotic cleavage of cellular proteins
Inactivation, recovery and regulation of the phototransduction cascadeR-HSA-2514859:Inactivation, recovery and regulation of the phototransduction cascade
WikiPathways Visual phototransduction
Apoptotic execution phaseWP2776:Visual phototransduction
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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