EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:112811 - 1-methyl-4-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid ethyl ester

ChEBI IDCHEBI:112811
ChEBI Name1-methyl-4-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid ethyl ester
Stars
DownloadsMolfile
FormulaC22H26N4O3
Net Charge0
Average Mass394.475
Monoisotopic Mass394.20049
SMILESCCOC(=O)c1cc2c(ccn2C)n1CC(=O)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C22H26N4O3/c1-3-29-22(28)20-15-19-18(9-10-23(19)2)26(20)16-21(27)25-13-11-24(12-14-25)17-7-5-4-6-8-17/h4-10,15H,3,11-14,16H2,1-2H3
InChIKeyIVJLCDDHHVISLL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-methyl-4-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid ethyl ester (CHEBI:112811) is a piperazines (CHEBI:26144)
Manual XrefsDatabases
LSM-24221LINCS