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CHEBI:231340 - GSK503

Default Structure
ChEBI IDCHEBI:231340
ChEBI NameGSK503
Stars
DefinitionGSK503 is a potent and specific inhibitor of EZH2 methyltransferase.
Submitterdelphine
DownloadsMolfile
FormulaC31H38N6O2
Net Charge0
Average Mass526.685
Monoisotopic Mass526.30562
SMILESCc1cc(C)c(CNC(=O)c2cc(-c3ccc(N4CCN(C)CC4)nc3)cc3c2c(C)cn3C(C)C)c(=O)n1
InChIInChI=1S/C31H38N6O2/c1-19(2)37-18-21(4)29-25(30(38)33-17-26-20(3)13-22(5)34-31(26)39)14-24(15-27(29)37)23-7-8-28(32-16-23)36-11-9-35(6)10-12-36/h7-8,13-16,18-19H,9-12,17H2,1-6H3,(H,33,38)(H,34,39)
InChIKeyHRDQQHUKUIKFHT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
GSK503 (CHEBI:231340) is a organic molecular entity (CHEBI:50860)
IUPAC Names 
N-[(1,2-Dihydro-4,6-dimethyl-2-oxo-3-pyridinyl)methyl]-3-methyl-1-(1-methylethyl)-6-[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-1H-indole-4-carboxamide
N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-1-isopropyl-3-methyl-6-(6-(4-methylpiperazin-1-yl)pyridin-3-yl)-1H-indole-4-carboxamide
Synonyms  Source
GSK 503SUBMITTER
GSK-503SUBMITTER
Registry NumbersSources
CAS:1346572-63-1SUBMITTER