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CHEBI:144344 - Phthalic acid, di(3-methylphenyl) ester

Default Structure
ChEBI IDCHEBI:144344
ChEBI NamePhthalic acid, di(3-methylphenyl) ester
Stars
Submittermwilliams
DownloadsMolfile
FormulaC22H18O4
Net Charge0
Average Mass346.382
Monoisotopic Mass346.12051
SMILESCc1cccc(OC(=O)c2ccccc2C(=O)Oc2cccc(C)c2)c1
InChIInChI=1S/C22H18O4/c1-15-7-5-9-17(13-15)25-21(23)19-11-3-4-12-20(19)22(24)26-18-10-6-8-16(2)14-18/h3-14H,1-2H3
InChIKeyCNZWUMLUHRMYDE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) umbilical vein endothelial cell line (BTO:0001520) MetaboLights (MTBLS739)
ChEBI Ontology
Outgoing Relation(s)
Phthalic acid, di(3-methylphenyl) ester (CHEBI:144344) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
bis(3-methylphenyl) benzene-1,2-dicarboxylate