bracteatin 6-O-beta-glucoside (CHEBI:66907)

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CHEBI:66907 - bracteatin 6-O-β-glucoside

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ChEBI ID	CHEBI:66907
ChEBI Name	bracteatin 6-O-β-glucoside
Stars
ASCII Name	bracteatin 6-O-beta-glucoside
Definition	A β-D-glucoside in which a β-D-glucopyranosyl residue is attached at position 6 of bracteatin via a glycosidic linkage.
Last Modified	3 August 2014
Submitter	KAX
Downloads	Molfile

Formula	C21H20O12
Net Charge	0
Average Mass	464.379
Monoisotopic Mass	464.09548
SMILES	O=C1C(=Cc2cc(O)c(O)c(O)c2)Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21
InChI	InChI=1S/C21H20O12/c22-6-14-18(28)19(29)20(30)21(33-14)31-8-4-9(23)15-12(5-8)32-13(17(15)27)3-7-1-10(24)16(26)11(25)2-7/h1-5,14,18-26,28-30H,6H2/t14-,18-,19+,20-,21-/m1/s1
InChIKey	SFXSFWVZPKEDPA-LNCSSOGTSA-N

ChEBI Ontology

Outgoing Relation(s)
	bracteatin 6-O-β-glucoside (CHEBI:66907) has functional parent bracteatin (CHEBI:3163)
	bracteatin 6-O-β-glucoside (CHEBI:66907) is a β-D-glucoside (CHEBI:22798)

IUPAC Name
4-hydroxy-3-oxo-2-(3,4,5-trihydroxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl β-D-glucopyranoside

Synonym	Source
bracteatin 6-O-β-D-glucoside	ChEBI

UniProt Name	Source
bracteatin 6-O-β-glucoside	UniProt

Manual Xrefs	Databases
C00008060	KNApSAcK
C16410	KEGG COMPOUND
CPD-8635	MetaCyc
LMPK12130043	LIPID MAPS

Citations