6-(5-carboxy-2-hydroxy-3-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:186729)

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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	6-(5-carboxy-2-hydroxy-3-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

ChEBI ID	CHEBI:186729

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H16O11

Net Charge

Average Mass

360.271

Monoisotopic Mass

360.06926

InChI

InChI=1S/C14H16O11/c1-23-5-2-4(12(19)20)3-6(7(5)15)24-14-10(18)8(16)9(17)11(25-14)13(21)22/h2-3,8-11,14-18H,1H3,(H,19,20)(H,21,22)

InChIKey

ILWDNUVZYSRINE-UHFFFAOYSA-N

SMILES

O1C(C(O)C(O)C(O)C1OC=2C(O)=C(OC)C=C(C2)C(O)=O)C(O)=O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

Roles Classification
Application(s):	astringent A compound that causes the contraction of body tissues, typically used to reduce bleeding from minor abrasions. (via tannin )

ChEBI Ontology
Outgoing	6-(5-carboxy-2-hydroxy-3-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:186729) is a tannin (CHEBI:26848)

IUPAC Name

6-(5-carboxy-2-hydroxy-3-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid