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CHEBI:72297 - lomitapide

ChEBI IDCHEBI:72297
ChEBI Namelomitapide
Stars
DefinitionA member of the class of benzamides obtained by formal condensation of the carboxy group of 4'-(trifluoromethyl)biphenyl-2-carboxylic acid with the primary amino group of 9-[4-(4-aminopiperidin-1-yl)butyl]-N-(2,2,2-trifluoroethyl)-9H-fluorene-9-carboxamide. Used (as its mesylate salt) as a complement to a low-fat diet and other lipid-lowering treatments in patients with homozygous familial hypercholesterolemia.
Last Modified25 July 2017
SubmitterSteve
DownloadsMolfile
FormulaC39H37F6N3O2
Net Charge0
Average Mass693.732
Monoisotopic Mass693.27900
SMILESO=C(NC1CCN(CCCCC2(C(=O)NCC(F)(F)F)c3ccccc3-c3ccccc32)CC1)c1ccccc1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C39H37F6N3O2/c40-38(41,42)25-46-36(50)37(33-13-5-3-10-30(33)31-11-4-6-14-34(31)37)21-7-8-22-48-23-19-28(20-24-48)47-35(49)32-12-2-1-9-29(32)26-15-17-27(18-16-26)39(43,44)45/h1-6,9-18,28H,7-8,19-25H2,(H,46,50)(H,47,49)
InChIKeyMBBCVAKAJPKAKM-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
MTP inhibitor  An inhibitor that interferes with the action of MTP.
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Application:
anticholesteremic drug  A substance used to lower plasma cholesterol levels.
ChEBI Ontology
Outgoing Relation(s)
lomitapide (CHEBI:72297) has role anticholesteremic drug (CHEBI:35821)
lomitapide (CHEBI:72297) has role MTP inhibitor (CHEBI:72298)
lomitapide (CHEBI:72297) is a (trifluoromethyl)benzenes (CHEBI:83565)
lomitapide (CHEBI:72297) is a benzamides (CHEBI:22702)
lomitapide (CHEBI:72297) is a fluorenes (CHEBI:24059)
lomitapide (CHEBI:72297) is a piperidines (CHEBI:26151)
lomitapide (CHEBI:72297) is conjugate base of lomitapide(1+) (CHEBI:72302)
Incoming Relation(s)
lomitapide(1+) (CHEBI:72302) is conjugate acid of lomitapide (CHEBI:72297)
IUPAC Name 
N-(2,2,2-trifluoroethyl)-9-{4-[4-({[4'-(trifluoromethyl)biphenyl-2-yl]carbonyl}amino)piperidin-1-yl]butyl}-9H-fluorene-9-carboxamide
INNs  Source
lomitapideKEGG DRUG
lomitapidaWHO MedNet
lomitapidumWHO MedNet
lomitapideWHO MedNet
Synonyms  Source
AEGR 733ChemIDplus
BMS 201038ChemIDplus
BMS201038DrugCentral
BMS-201038DrugCentral
JuxtapidDrugCentral
LojuxtaDrugCentral
Manual XrefsDatabases
D09637KEGG DRUG
US2008161279Patent
US2003162788Patent
LomitapideWikipedia
US2011288064Patent
US2011288110Patent
US2012071458Patent
US2012035204Patent
US2010273829Patent
4721DrugCentral
DB08827DrugBank
Registry NumbersSources
Reaxys:13754976Reaxys
CAS:182431-12-5KEGG DRUG
CAS:182431-12-5ChemIDplus
Citations