Drug Information

Drug General Information
Drug ID
D0D1XG
Former ID
DNC000429
Drug Name
CI-976
Drug Type
Small molecular drug
Indication Hyperlipidaemia [ICD9: 272.0-272.4; ICD10:E78] Discontinued in Phase 2 [544811]
Structure
Download
2D MOL

3D MOL
Formula
C23H39NO4
Canonical SMILES
CCCCCCCCCCC(C)(C)C(=O)NC1=C(C=C(C=C1OC)OC)OC
InChI
1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25)
InChIKey
WAFNZAURAWBNDZ-UHFFFAOYSA-N
CAS Number
CAS 114289-47-3
PubChem Compound ID
122327
PubChem Substance ID
4115926, 10240022, 14903215, 26753242, 29302726, 49964468, 57340083, 77469630, 85789074, 89061200, 90341464, 103190900, 103919368, 104415561, 118273684, 121361683, 124593932, 124891584, 124891585, 125674308, 129552519, 134964463, 135076729, 137095862, 143123997, 162023140, 162248098, 162282272, 162776978, 163564813, 172657955, 175612582, 184536679, 215779447, 226984929, 242083240, 252156373, 252329085
Target and Pathway
Target(s) Liver carboxylesterase Target Info Inhibitor [537864]
KEGG Pathway Drug metabolism - other enzymes
Metabolic pathways
Pathway Interaction Database E2F transcription factor network
WikiPathways NRF2 pathway
Nuclear Receptors Meta-Pathway
Heroin metabolism
Irinotecan Pathway
Fluoropyrimidine Activity
Phase I biotransformations, non P450
References
Ref 544811Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800001196)
Ref 537864Acyl-coenzyme A:cholesterol-acyltransferase (ACAT) inhibitors modulate monocyte adhesion to aortic endothelial cells. Atherosclerosis. 1995 Jan 6;112(1):7-17.

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