luteolin 7-O-beta-D-glucoside-4'-(Z-2-methyl-2-butenoate) (CHEBI:85149)

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CHEBI:85149 - luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate)

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ChEBI ID	CHEBI:85149
ChEBI Name	luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate)
Stars
ASCII Name	luteolin 7-O-beta-D-glucoside-4'-(Z-2-methyl-2-butenoate)
Definition	An enoate ester obtained by the formal condensation of the 4'-hydroxy group of luteolin 7-O-β-D-glucoside with the carboxy group of angelic acid.
Last Modified	9 March 2015
Submitter	namrata
Downloads	Molfile

Formula	C26H26O12
Net Charge	0
Average Mass	530.482
Monoisotopic Mass	530.14243
SMILES	C/C=C(/C)C(=O)Oc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O
InChI	InChI=1S/C26H26O12/c1-3-11(2)25(34)37-17-5-4-12(6-14(17)28)18-9-16(30)21-15(29)7-13(8-19(21)36-18)35-26-24(33)23(32)22(31)20(10-27)38-26/h3-9,20,22-24,26-29,31-33H,10H2,1-2H3/b11-3-/t20-,22-,23+,24-,26-/m1/s1
InChIKey	VEORDRJFZGGQLP-YQROEJBVSA-N

Species of Metabolite	Component	Source	Comments
Centella asiatica (ncbitaxon:48106)	-	MetaboLights (MTBLS175)

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)
	luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate) (CHEBI:85149) has functional parent angelic acid (CHEBI:36431)
	luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate) (CHEBI:85149) has functional parent luteolin 7-O-β-D-glucoside (CHEBI:27994)
	luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate) (CHEBI:85149) has role plant metabolite (CHEBI:76924)
	luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate) (CHEBI:85149) is a dihydroxyflavone (CHEBI:38686)
	luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate) (CHEBI:85149) is a enoate ester (CHEBI:51702)
	luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate) (CHEBI:85149) is a glycosyloxyflavone (CHEBI:50018)
	luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate) (CHEBI:85149) is a monosaccharide derivative (CHEBI:63367)
	luteolin 7-O-β-D-glucoside-4'-(Z-2-methyl-2-butenoate) (CHEBI:85149) is a β-D-glucoside (CHEBI:22798)

IUPAC Name
4-[7-(β-D-glucopyranosyloxy)-5-hydroxy-4-oxo-4H-chromen-2-yl]-2-hydroxyphenyl (2Z)-2-methylbut-2-enoate

Synonym	Source
5,3'-dihydroxy-4'-O-angeloxyflavone-7-O-β-D-glucopyranoside	ChEBI

Manual Xrefs	Databases
C00013668	KNApSAcK

Registry Numbers	Sources
Reaxys:9241697	Reaxys