CHEBI:85132 - glycitein 7-O-β-D-(2'',4'',6''-O-triacetyl)glucopyranoside

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ChEBI Name glycitein 7-O-β-D-(2'',4'',6''-O-triacetyl)glucopyranoside
ChEBI ID CHEBI:85132
ChEBI ASCII Name glycitein 7-O-beta-D-(2'',4'',6''-O-triacetyl)glucopyranoside
Definition A glycosyloxyisoflavone that is the 2'',4'',6''-O-triacetyl- derivative of glycitin.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H28O13
Net Charge 0
Average Mass 572.51410
Monoisotopic Mass 572.15299
InChI InChI=1S/C28H28O13/c1-13(29)36-12-23-26(38-14(2)30)25(34)27(39-15(3)31)28(41-23)40-22-10-20-18(9-21(22)35-4)24(33)19(11-37-20)16-5-7-17(32)8-6-16/h5-11,23,25-28,32,34H,12H2,1-4H3/t23-,25+,26-,27-,28-/m1/s1
InChIKey AAOWDCXVOOKARC-BYUBTRPSSA-N
SMILES COc1cc2c(cc1O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](O)[C@H]1OC(C)=O)occ(-c1ccc(O)cc1)c2=O
Metabolite of Species Details
Centella asiatica (NCBI:txid48106) See: MetaboLights Study
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing glycitein 7-O-β-D-(2'',4'',6''-O-triacetyl)glucopyranoside (CHEBI:85132) has functional parent glycitin (CHEBI:80373)
glycitein 7-O-β-D-(2'',4'',6''-O-triacetyl)glucopyranoside (CHEBI:85132) has role plant metabolite (CHEBI:76924)
glycitein 7-O-β-D-(2'',4'',6''-O-triacetyl)glucopyranoside (CHEBI:85132) is a acetate ester (CHEBI:47622)
glycitein 7-O-β-D-(2'',4'',6''-O-triacetyl)glucopyranoside (CHEBI:85132) is a glycosyloxyisoflavone (CHEBI:74630)
glycitein 7-O-β-D-(2'',4'',6''-O-triacetyl)glucopyranoside (CHEBI:85132) is a hydroxyisoflavone (CHEBI:38755)
glycitein 7-O-β-D-(2'',4'',6''-O-triacetyl)glucopyranoside (CHEBI:85132) is a methoxyisoflavone (CHEBI:38756)
glycitein 7-O-β-D-(2'',4'',6''-O-triacetyl)glucopyranoside (CHEBI:85132) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name
3-(4-hydroxyphenyl)-6-methoxy-4-oxo-4H-chromen-7-yl 2,4,6-tri-O-acetyl-β-D-glucopyranoside
Registry Number Type Source
8372851 Reaxys Registry Number Reaxys
Last Modified
06 March 2015