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CHEBI:202637 - 7-(4-aminophenyl)-2,4-dimethyl-7-oxo-hept-5-enoic acid

Default Structure
ChEBI IDCHEBI:202637
ChEBI Name7-(4-aminophenyl)-2,4-dimethyl-7-oxo-hept-5-enoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H19NO3
Net Charge0
Average Mass261.321
Monoisotopic Mass261.13649
SMILESCC(/C=C/C(=O)c1ccc(N)cc1)CC(C)C(=O)O
InChIInChI=1S/C15H19NO3/c1-10(9-11(2)15(18)19)3-8-14(17)12-4-6-13(16)7-5-12/h3-8,10-11H,9,16H2,1-2H3,(H,18,19)/b8-3+
InChIKeyJNYXIBXBHMJEBQ-FPYGCLRLSA-N
Species of MetaboliteComponentSourceComments
Streptomyces griseus (ncbitaxon:1911) - PubMed (16124760)
ChEBI Ontology
Outgoing Relation(s)
7-(4-aminophenyl)-2,4-dimethyl-7-oxo-hept-5-enoic acid (CHEBI:202637) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(E)-7-(4-aminophenyl)-2,4-dimethyl-7-oxohept-5-enoic acid
Manual XrefsDatabases
9812226ChemSpider