CHEBI:228099 - 5-acetyl-2, 4-dihydroxy-3-methylbenzoic acid

ChEBI IDCHEBI:228099
ChEBI Name5-acetyl-2, 4-dihydroxy-3-methylbenzoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10O5
Net Charge0
Average Mass210.185
Monoisotopic Mass210.05282
SMILESCC(=O)c1cc(C(=O)O)c(O)c(C)c1O
InChIInChI=1S/C10H10O5/c1-4-8(12)6(5(2)11)3-7(9(4)13)10(14)15/h3,12-13H,1-2H3,(H,14,15)
InChIKeyUNJGBPHJDYXWNJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/j.phytol.2019.09.004)
ChEBI Ontology
Outgoing Relation(s)
5-acetyl-2, 4-dihydroxy-3-methylbenzoic acid (CHEBI:228099) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
5-acetyl-2,4-dihydroxy-3-methylbenzoic acid
Manual XrefsDatabases
80564757ChemSpider