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CHEBI:2738 - Anisotine

ChEBI IDCHEBI:2738
ChEBI NameAnisotine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H19N3O3
Net Charge0
Average Mass349.390
Monoisotopic Mass349.14264
SMILES[H]C1(c2ccc(NC)c(C(=O)OC)c2)CCn2c1nc1ccccc1c2=O
InChIInChI=1S/C20H19N3O3/c1-21-16-8-7-12(11-15(16)20(25)26-2)13-9-10-23-18(13)22-17-6-4-3-5-14(17)19(23)24/h3-8,11,13,21H,9-10H2,1-2H3
InChIKeyFZKRWTVMKFSFSG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Anisotine (CHEBI:2738) is a quinazolines (CHEBI:38530)
Synonym  Source
AnisotineKEGG COMPOUND
Manual XrefsDatabases
C10639KEGG COMPOUND
C00002134KNApSAcK
Registry NumbersSources
CAS:16688-19-0KEGG COMPOUND