CHEBI:62251 - 2-(β-D-glucosyloxy)-cis-cinnamic acid

ChEBI IDCHEBI:62251
ChEBI Name2-(β-D-glucosyloxy)-cis-cinnamic acid
Stars
ASCII Name2-(beta-D-glucosyloxy)-cis-cinnamic acid
DefinitionA β-D-glucoside consisting of cis-2-coumaric acid having a β-D-glucosyl residue attached to the phenolic hydroxy group.
Last Modified28 July 2014
SubmitterSteve
DownloadsMolfile
FormulaC15H18O8
Net Charge0
Average Mass326.301
Monoisotopic Mass326.10017
SMILESO=C(O)/C=C\c1ccccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(23-10)22-9-4-2-1-3-8(9)5-6-11(17)18/h1-6,10,12-16,19-21H,7H2,(H,17,18)/b6-5-/t10-,12-,13+,14-,15-/m1/s1
InChIKeyGVRIYIMNJGULCZ-QLFWQTQQSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(β-D-glucosyloxy)-cis-cinnamic acid (CHEBI:62251) has functional parent cis-2-coumaric acid (CHEBI:28873)
2-(β-D-glucosyloxy)-cis-cinnamic acid (CHEBI:62251) is a β-D-glucoside (CHEBI:22798)
2-(β-D-glucosyloxy)-cis-cinnamic acid (CHEBI:62251) is conjugate acid of 2-(β-D-glucosyloxy)-cis-cinnamate (CHEBI:62223)
Incoming Relation(s)
2-(β-D-glucosyloxy)-cis-cinnamate (CHEBI:62223) is conjugate base of 2-(β-D-glucosyloxy)-cis-cinnamic acid (CHEBI:62251)
IUPAC Name 
(2Z)-3-[2-(β-D-glucopyranosyloxy)phenyl]prop-2-enoic acid
Synonyms  Source
(2Z)-3-[2-(β-D-glucopyranosyloxy)phenyl]acrylic acidIUPAC
beta-D-Glucosyl-2-coumarinateKEGG COMPOUND
cis-coumarinic acid-β-D-glucosideMetaCyc
cis-melilotosideChEBI
cis-β-D-glucosyl-2-hydroxycinnamic acidChEBI
β-D-glucosyl-2-coumarinic acidChEBI
Manual XrefsDatabases
C05839KEGG COMPOUND
CPD-7417MetaCyc
Registry NumbersSources
Reaxys:21126837Reaxys
Citations