CHEBI:80944 - tribuloside

ChEBI IDCHEBI:80944
ChEBI Nametribuloside
Stars
DefinitionA glycosyloxyflavone that is kaempferol attached to a 6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-β-D-glucopyranosyl residue at position 3 via a glycosidic linkage.
Last Modified13 March 2015
DownloadsMolfile
FormulaC30H26O13
Net Charge0
Average Mass594.525
Monoisotopic Mass594.13734
SMILESO=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C30H26O13/c31-16-6-1-14(2-7-16)3-10-22(35)40-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(33)12-20(23)41-28(29)15-4-8-17(32)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2/b10-3+/t21-,24-,26+,27-,30+/m1/s1
InChIKeyDVGGLGXQSFURLP-VWMSDXGPSA-N
Species of MetaboliteComponentSourceComments
Potentilla multifida (ncbitaxon:210859) - PubMed (17504571)
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)
tribuloside (CHEBI:80944) has functional parent trans-4-coumaric acid (CHEBI:32374)
tribuloside (CHEBI:80944) has functional parent kaempferol (CHEBI:28499)
tribuloside (CHEBI:80944) has role plant metabolite (CHEBI:76924)
tribuloside (CHEBI:80944) is a cinnamate ester (CHEBI:36087)
tribuloside (CHEBI:80944) is a glycosyloxyflavone (CHEBI:50018)
tribuloside (CHEBI:80944) is a monosaccharide derivative (CHEBI:63367)
tribuloside (CHEBI:80944) is a trihydroxyflavone (CHEBI:27116)
IUPAC Name 
5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4E-1-benzopyran-3-yl 6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-β-D-glucopyranoside
Synonym  Source
kaempferol-3-O-β-D-(6''-(E)-p-coumaroyl)-glucopyranosideChEBI
Manual XrefsDatabases
C17140KEGG COMPOUND
C00034908KNApSAcK
CN1857471Patent
Registry NumbersSources
Reaxys:3642768Reaxys
Citations