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CHEBI:232521 - CB-5083

ChEBI IDCHEBI:232521
ChEBI NameCB-5083
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FormulaC24H23N5O2
Net Charge0
Average Mass413.481
Monoisotopic Mass413.18517
SMILESCc1cc2c(C(=N)O)cccc2n1-c1nc2c(/c(=N/Cc3ccccc3)n1)COCC2
InChIInChI=1S/C24H23N5O2/c1-15-12-18-17(22(25)30)8-5-9-21(18)29(15)24-27-20-10-11-31-14-19(20)23(28-24)26-13-16-6-3-2-4-7-16/h2-9,12H,10-11,13-14H2,1H3,(H2,25,30)(H,26,27,28)
InChIKeyRDALZZCKQFLGJP-UHFFFAOYSA-N
Roles Classification
Biological Role:
inhibitor  A substance that diminishes the rate of a chemical reaction.
ChEBI Ontology
Outgoing Relation(s)
CB-5083 (CHEBI:232521) has role inhibitor (CHEBI:35222)
CB-5083 (CHEBI:232521) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
1-[4-(benzylamino)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-2-yl]-2-methylindole-4-carboxamide
Registry NumbersSources
CAS:1542705-92-9SUBMITTER