CHEBI:145341 - 4-O-β-D-glucosyl-trans-sinapic acid

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ChEBI Name 4-O-β-D-glucosyl-trans-sinapic acid
ChEBI ID CHEBI:145341
ChEBI ASCII Name 4-O-beta-D-glucosyl-trans-sinapic acid
Definition A β-D-glucoside resulting from the formal condensation of the phenolic hydroxy group of trans-sinapic acid with β-D-gucopyranose.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C17H22O10
Net Charge 0
Average Mass 386.353
Monoisotopic Mass 386.12130
InChI InChI=1S/C17H22O10/c1-24-9-5-8(3-4-12(19)20)6-10(25-2)16(9)27-17-15(23)14(22)13(21)11(7-18)26-17/h3-6,11,13-15,17-18,21-23H,7H2,1-2H3,(H,19,20)/b4-3+/t11-,13-,14+,15-,17+/m1/s1
InChIKey KKLWTTVTWMTNBP-KYXYLJOWSA-N
SMILES C=1(C=C(C=C(C1O[C@@H]2O[C@@H]([C@H]([C@@H]([C@H]2O)O)O)CO)OC)/C=C/C(=O)O)OC
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4-O-β-D-glucosyl-trans-sinapic acid (CHEBI:145341) has functional parent trans-sinapic acid (CHEBI:15714)
4-O-β-D-glucosyl-trans-sinapic acid (CHEBI:145341) is a β-D-glucoside (CHEBI:22798)
4-O-β-D-glucosyl-trans-sinapic acid (CHEBI:145341) is a dimethoxybenzene (CHEBI:51681)
4-O-β-D-glucosyl-trans-sinapic acid (CHEBI:145341) is a methoxycinnamic acid (CHEBI:61407)
4-O-β-D-glucosyl-trans-sinapic acid (CHEBI:145341) is a monosaccharide derivative (CHEBI:63367)
4-O-β-D-glucosyl-trans-sinapic acid (CHEBI:145341) is conjugate acid of 4-O-β-D-glucosyl-trans-sinapate (CHEBI:141763)
Incoming 4-O-β-D-glucosyl-trans-sinapate (CHEBI:141763) is conjugate base of 4-O-β-D-glucosyl-trans-sinapic acid (CHEBI:145341)
IUPAC Name
(2E)-3-[4-(β-D-glucopyranosyloxy)-3,5-dimethoxyphenyl]acrylic acid
Synonyms Sources
4-O-(β-D-glucopyranosyl)-(2E)-sinapic acid ChEBI
4-O-(β-D-glucosyl)-(2E)-sinapic acid ChEBI
O4-(β-D-glucosyl)-(2E)-sinapic acid ChEBI
sinapoyl-4-O-β-D-glucoside ChEBI
Manual Xrefs Databases
1-SINAPOYL-D-GLUCOSE MetaCyc
C02919 KEGG COMPOUND
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Citation Waiting for Citations Type Source
11042211 PubMed citation SUBMITTER
Last Modified
11 November 2019