(R)-Apiumetin glucoside (CHEBI:176002)

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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	(R)-Apiumetin glucoside

ChEBI ID	CHEBI:176002

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H22O9

Net Charge

Average Mass

406.387

Monoisotopic Mass

406.12638

InChI

InChI=1S/C20H22O9/c1-8(2)11-6-10-5-9-3-4-13(22)28-17(9)19(18(10)26-11)29-20-16(25)15(24)14(23)12(7-21)27-20/h3-5,11-12,14-16,20-21,23-25H,1,6-7H2,2H3

InChIKey

VPAPSBNFWBXZLU-UHFFFAOYSA-N

SMILES

O1C(C(O)C(O)C(O)C1OC=2C=3OC(CC3C=C4C2OC(=O)C=C4)C(C)=C)CO

ChEBI Ontology
Outgoing	(R)-Apiumetin glucoside (CHEBI:176002) is a coumarins (CHEBI:23403) (R)-Apiumetin glucoside (CHEBI:176002) is a glycoside (CHEBI:24400)

IUPAC Name

2-prop-1-en-2-yl-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrouro[3,2-g]chromen-7-one