EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:117223 - 2-amino-3-cyano-5,6,7,8-tetrahydroquinoline-4-carboxylic acid methyl ester

ChEBI IDCHEBI:117223
ChEBI Name2-amino-3-cyano-5,6,7,8-tetrahydroquinoline-4-carboxylic acid methyl ester
Stars
DownloadsMolfile
FormulaC12H13N3O2
Net Charge0
Average Mass231.255
Monoisotopic Mass231.10078
SMILESCOC(=O)c1c(C#N)c(N)nc2c1CCCC2
InChIInChI=1S/C12H13N3O2/c1-17-12(16)10-7-4-2-3-5-9(7)15-11(14)8(10)6-13/h2-5H2,1H3,(H2,14,15)
InChIKeyKTHIJTUJUXPDDZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-amino-3-cyano-5,6,7,8-tetrahydroquinoline-4-carboxylic acid methyl ester (CHEBI:117223) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-28672LINCS