methyl 2-ormyl-3,4,5-trihydroxy-6-methylbenzoate (CHEBI:208650)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:208650 - methyl 2-ormyl-3,4,5-trihydroxy-6-methylbenzoate

Take structure to advanced search

ChEBI ID	CHEBI:208650
ChEBI Name	methyl 2-ormyl-3,4,5-trihydroxy-6-methylbenzoate
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C10H10O6
Net Charge	0
Average Mass	226.184
Monoisotopic Mass	226.04774
SMILES	COC(=O)c1c(C)c(O)c(O)c(O)c1C=O
InChI	InChI=1S/C10H10O6/c1-4-6(10(15)16-2)5(3-11)8(13)9(14)7(4)12/h3,12-14H,1-2H3
InChIKey	RWVLNFASYOESSQ-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Mycosphaerella (ncbitaxon:41254)	-	PubMed (31434338)

ChEBI Ontology

Outgoing Relation(s)
	methyl 2-ormyl-3,4,5-trihydroxy-6-methylbenzoate (CHEBI:208650) is a gallate ester (CHEBI:37576)

IUPAC Name
methyl 2-ormyl-3,4,5-trihydroxy-6-methylbenzoate

Manual Xrefs	Databases
77295030	ChemSpider