EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:220981 - methyl 2-(2,6-dihydroxy-4-methylbenzoyl)-3,5-dimethoxybenzoate

ChEBI IDCHEBI:220981
ChEBI Namemethyl 2-(2,6-dihydroxy-4-methylbenzoyl)-3,5-dimethoxybenzoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H18O7
Net Charge0
Average Mass346.335
Monoisotopic Mass346.10525
SMILESCOC(=O)c1cc(OC)cc(OC)c1C(=O)c1c(O)cc(C)cc1O
InChIInChI=1S/C18H18O7/c1-9-5-12(19)16(13(20)6-9)17(21)15-11(18(22)25-4)7-10(23-2)8-14(15)24-3/h5-8,19-20H,1-4H3
InChIKeyYLCJNMGKCHGJRF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1271/bbb1961.47.163)
ChEBI Ontology
Outgoing Relation(s)
methyl 2-(2,6-dihydroxy-4-methylbenzoyl)-3,5-dimethoxybenzoate (CHEBI:220981) is a benzophenones (CHEBI:22726)
IUPAC Name 
methyl 2-(2,6-dihydroxy-4-methylbenzoyl)-3,5-dimethoxybenzoate
Manual XrefsDatabases
22369651ChemSpider