7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid 7-glucoside (CHEBI:175883)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid 7-glucoside

ChEBI ID	CHEBI:175883

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H18O10

Net Charge

Average Mass

382.321

Monoisotopic Mass

382.09000

InChI

InChI=1S/C17H18O10/c1-6-2-9(19)12-8(16(23)24)3-7(4-10(12)25-6)26-17-15(22)14(21)13(20)11(5-18)27-17/h2-4,11,13-15,17-18,20-22H,5H2,1H3,(H,23,24)

InChIKey

YXPDWQIPHUQHKB-UHFFFAOYSA-N

SMILES

O1C(C(O)C(O)C(O)C1OC=2C=C3OC(=CC(=O)C3=C(C2)C(O)=O)C)CO

ChEBI Ontology
Outgoing	7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid 7-glucoside (CHEBI:175883) is a glycoside (CHEBI:24400)

IUPAC Name

2-methyl-4-oxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromene-5-carboxylic acid