4,5,6-trihydroxy-3-methyl-3H-2-benzouran-1-one (CHEBI:223568)

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CHEBI:223568 - 4,5,6-trihydroxy-3-methyl-3H-2-benzouran-1-one

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ChEBI ID	CHEBI:223568
ChEBI Name	4,5,6-trihydroxy-3-methyl-3H-2-benzouran-1-one
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C9H8O5
Net Charge	0
Average Mass	196.158
Monoisotopic Mass	196.03717
SMILES	C[C@@H]1OC(=O)c2cc(O)c(O)c(O)c21
InChI	InChI=1S/C9H8O5/c1-3-6-4(9(13)14-3)2-5(10)7(11)8(6)12/h2-3,10-12H,1H3/t3-/m0/s1
InChIKey	AGUVVAYMPQDJDX-VKHMYHEASA-N

Species of Metabolite	Component	Source	Comments
Oidiodendron (ncbitaxon:78141)	-	PubMed (15620258)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	4,5,6-trihydroxy-3-methyl-3H-2-benzouran-1-one (CHEBI:223568) is a trihydroxybenzoic acid (CHEBI:27115)

IUPAC Name
4,5,6-trihydroxy-3-methyl-3H-2-benzouran-1-one

Manual Xrefs	Databases
9599004	ChemSpider