CHEBI:70778 - GW 7647

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ChEBI Name GW 7647
ChEBI ID CHEBI:70778
Definition A monocarboxylic acid that is 2-(phenylsulfanyl)isobutyric acid in which the phenyl group is substituted at the para- position by a 3-aza-7-cyclohexylhept-1-yl group in which the nitrogen is acylated by a (cyclohexylamino)carbonyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C29H46N2O3S
Net Charge 0
Average Mass 502.75200
Monoisotopic Mass 502.32291
InChI InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)
InChIKey PKNYXWMTHFMHKD-UHFFFAOYSA-N
SMILES CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): PPARalpha agonist
A PPAR modulator which activates the peroxisome proliferator-activated receptor-alpha.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing GW 7647 (CHEBI:70778) has role PPARα agonist (CHEBI:70782)
GW 7647 (CHEBI:70778) is a aryl sulfide (CHEBI:35683)
GW 7647 (CHEBI:70778) is a monocarboxylic acid (CHEBI:25384)
GW 7647 (CHEBI:70778) is a ureas (CHEBI:47857)
IUPAC Name
2-[(4-{2-[(4-cyclohexylbutyl)(cyclohexylcarbamoyl)amino]ethyl}phenyl)sulfanyl]-2-methylpropanoic acid
Synonyms Sources
2-((4-(2-(1-cyclohexylbutyl)-3-cyclohexylureido)ethyl)phenylthio)-2-methylpropionic acid ChEBI
2-(4-(2-(1-(4-cyclohexylbutyl)-3-cyclohexylureido)ethyl)phenylthio)-2-methylpropionic acid ChEBI
2-(4-(2-(1-(cyclohexanebutyl)-3-cyclohexylureido)ethyl)phenylthio)-2-methylpropionic acid ChEBI
2-({4-{2-{{(cyclohexylamino)carbonyl}(4-cyclohexylbutyl)amino}ethyl}phenyl}thio)-2-methylpropanoic acid ChEBI
2-[[4-[2-[[(cyclohexylamino)carbonyl](4-cyclohexylbutyl)amino]ethyl]phenyl]thio]-2-methylpropanoic acid ChEBI
GW-7647 ChEBI
GW7647 ChEBI
Manual Xrefs Databases
C15622 KEGG COMPOUND
LSM-4172 LINCS
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Registry Numbers Types Sources
265129-71-3 CAS Registry Number KEGG COMPOUND
265129-71-3 CAS Registry Number ChemIDplus
8955332 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
14654352 PubMed citation Europe PMC
16839165 PubMed citation Europe PMC
17434479 PubMed citation Europe PMC
21443859 PubMed citation Europe PMC
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23008696 PubMed citation Europe PMC
Last Modified
25 February 2016