EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:181774 - Methyl 3,5-dimethoxy-2-(5-methoxy-4-oxo-6-prop-1-enylpyran-3-carbonyl)benzoate

ChEBI IDCHEBI:181774
ChEBI NameMethyl 3,5-dimethoxy-2-(5-methoxy-4-oxo-6-prop-1-enylpyran-3-carbonyl)benzoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20O8
Net Charge0
Average Mass388.372
Monoisotopic Mass388.11582
SMILESCC=Cc1occ(C(=O)c2c(OC)cc(OC)cc2C(=O)OC)c(=O)c1OC
InChIInChI=1S/C20H20O8/c1-6-7-14-19(26-4)18(22)13(10-28-14)17(21)16-12(20(23)27-5)8-11(24-2)9-15(16)25-3/h6-10H,1-5H3
InChIKeyWGLRJONCGNNMKL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Methyl 3,5-dimethoxy-2-(5-methoxy-4-oxo-6-prop-1-enylpyran-3-carbonyl)benzoate (CHEBI:181774) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
methyl 3,5-dimethoxy-2-(5-methoxy-4-oxo-6-prop-1-enylpyran-3-carbonyl)benzoate