7-O-methylvitexin 2''-O-beta-L-rhamnoside (CHEBI:82684)

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CHEBI:82684 - 7-O-methylvitexin 2''-O-β-L-rhamnoside

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ChEBI ID	CHEBI:82684
ChEBI Name	7-O-methylvitexin 2''-O-β-L-rhamnoside
Stars
ASCII Name	7-O-methylvitexin 2''-O-beta-L-rhamnoside
Definition	A dihydroxyflavone that is vitexin having a β-L-rhamnosyl residue attached at the 2''-position of the glucitol moiety and a methyl group attached at the O-7 position of the chromene.
Last Modified	12 August 2014
Submitter	Steve
Downloads	Molfile

Formula	C28H32O14
Net Charge	0
Average Mass	592.550
Monoisotopic Mass	592.17921
SMILES	COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
InChI	InChI=1S/C28H32O14/c1-10-20(33)22(35)24(37)28(39-10)42-27-23(36)21(34)17(9-29)41-26(27)19-16(38-2)8-14(32)18-13(31)7-15(40-25(18)19)11-3-5-12(30)6-4-11/h3-8,10,17,20-24,26-30,32-37H,9H2,1-2H3/t10-,17+,20-,21+,22+,23-,24+,26-,27+,28+/m0/s1
InChIKey	HFUYHHROXLKXRR-FKTIEMRLSA-N

Species of Metabolite	Component	Source	Comments
Avena sativa (ncbitaxon:4498)	-	PubMed (6705789)

Roles Classification

Biological Role:

plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology

Outgoing Relation(s)
	7-O-methylvitexin 2''-O-β-L-rhamnoside (CHEBI:82684) has functional parent vitexin (CHEBI:16954)
	7-O-methylvitexin 2''-O-β-L-rhamnoside (CHEBI:82684) has role plant metabolite (CHEBI:76924)
	7-O-methylvitexin 2''-O-β-L-rhamnoside (CHEBI:82684) is a C-glycosyl compound (CHEBI:20857)
	7-O-methylvitexin 2''-O-β-L-rhamnoside (CHEBI:82684) is a dihydroxyflavone (CHEBI:38686)
	7-O-methylvitexin 2''-O-β-L-rhamnoside (CHEBI:82684) is a disaccharide derivative (CHEBI:63353)
	7-O-methylvitexin 2''-O-β-L-rhamnoside (CHEBI:82684) is a monomethoxyflavone (CHEBI:25401)
	7-O-methylvitexin 2''-O-β-L-rhamnoside (CHEBI:82684) is conjugate acid of 7-O-methylvitexin 2''-O-β-L-rhamnoside(1−) (CHEBI:78640)
Incoming Relation(s)
Incoming Relation(s)	7-O-methylvitexin 2''-O-β-L-rhamnoside(1−) (CHEBI:78640) is conjugate base of 7-O-methylvitexin 2''-O-β-L-rhamnoside (CHEBI:82684)

IUPAC Name
(1S)-1,5-anhydro-2-O-(β-L-rhamnopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxo-4H-chromen-8-yl]-D-glucitol

Synonyms	Source
isoswertisin 2''-O-β-L-rhamnoside	ChEBI
2''-α-rhamnopyranosyl-7-O-methylvitexin	ChEBI
(1S)-1,5-anhydro-2-O-(6-deoxy-β-L-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxo-4H-chromen-8-yl]-D-glucitol	IUPAC

Manual Xrefs	Databases
7-O-METHYLVITEXIN-2-O-B-L-RHAMNOSIDE	MetaCyc

Registry Numbers	Sources
Reaxys:20848896	Reaxys

Citations