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macrophomic acid

Go to external page http://purl.obolibrary.org/obo/CHEBI_38227

A methoxybenzoic acid having a single methoxy group at the 3-position together with acetyl and methyl substituents at the 4- and 5-positions respectively.

Term info

Label

macrophomic acid

Synonyms
  • 4-acetyl-3-methoxy-5-methylbenzoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
4-acetyl-3-methoxy-5-methylbenzoic acid [ IUPAC ]

charge

0

formula

C11H12O4

has obo namespace

chebi_ontology

id

CHEBI:38227

inchi

InChI=1S/C11H12O4/c1-6-4-8(11(13)14)5-9(15-3)10(6)7(2)12/h4-5H,1-3H3,(H,13,14)

inchikey

GWSISRLRTQOQNE-UHFFFAOYSA-N

mass

208.21058

monoisotopicmass

208.07356

smiles

COc1cc(cc(C)c1C(C)=O)C(O)=O