EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:120001 - LSM-31444

ChEBI IDCHEBI:120001
ChEBI NameLSM-31444
Stars
DownloadsMolfile
FormulaC21H18N2O4
Net Charge0
Average Mass362.385
Monoisotopic Mass362.12666
SMILESO=C(C=Cc1ccccc1)C1C(=O)NC(=O)N(CCc2ccccc2)C1=O
InChIInChI=1S/C21H18N2O4/c24-17(12-11-15-7-3-1-4-8-15)18-19(25)22-21(27)23(20(18)26)14-13-16-9-5-2-6-10-16/h1-12,18H,13-14H2,(H,22,25,27)
InChIKeyAWFNTRWBUVOYPF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-31444 (CHEBI:120001) has functional parent cinnamic acid (CHEBI:27386)
LSM-31444 (CHEBI:120001) is a olefinic compound (CHEBI:78840)
Manual XrefsDatabases
LSM-31444LINCS