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CHEBI:2734 - Anisessine

ChEBI IDCHEBI:2734
ChEBI NameAnisessine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H19N3O3
Net Charge0
Average Mass349.390
Monoisotopic Mass349.14264
SMILES[H]C1(Nc2ccccc2C(=O)OCC)CCn2c1nc1ccccc1c2=O
InChIInChI=1S/C20H19N3O3/c1-2-26-20(25)14-8-4-6-10-16(14)21-17-11-12-23-18(17)22-15-9-5-3-7-13(15)19(23)24/h3-10,17,21H,2,11-12H2,1H3
InChIKeyXESDUHSYWZBXPQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Anisessine (CHEBI:2734) is a quinazolines (CHEBI:38530)
Synonym  Source
AnisessineKEGG COMPOUND
Manual XrefsDatabases
C10637KEGG COMPOUND
C00002133KNApSAcK
Registry NumbersSources
CAS:16688-20-3KEGG COMPOUND