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CHEBI:216345 - CJ-13,564

ChEBI IDCHEBI:216345
ChEBI NameCJ-13,564
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H27NO2
Net Charge0
Average Mass325.452
Monoisotopic Mass325.20418
SMILESC/C(=C\Cc1c(C)c(=O)c2ccccc2n1C)CC[C@@H]1OC1(C)C
InChIInChI=1S/C21H27NO2/c1-14(11-13-19-21(3,4)24-19)10-12-17-15(2)20(23)16-8-6-7-9-18(16)22(17)5/h6-10,19H,11-13H2,1-5H3/b14-10+/t19-/m0/s1
InChIKeyDSXHBOUOVLEJIT-ATEOEAFZSA-N
Species of MetaboliteComponentSourceComments
Pseudonocardia (ncbitaxon:1847) - PubMed (9544935)
ChEBI Ontology
Outgoing Relation(s)
CJ-13,564 (CHEBI:216345) is a quinolines (CHEBI:26513)
IUPAC Name 
2-[(E)-5-(3,3-dimethyloxiran-2-yl)-3-methylpent-2-enyl]-1,3-dimethylquinolin-4-one
Manual XrefsDatabases
8037812ChemSpider