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CHEBI:75353 - tricin 7-O-[sinapoyl]-glucoside

ChEBI IDCHEBI:75353
ChEBI Nametricin 7-O-[sinapoyl]-glucoside
Stars
ASCII Nametricin 7-O-[sinapoyl]-glucoside
DefinitionA glycosyloxyflavone that is tricin 7-O-glucoside with the hydroxy group on the glycosyl ring at position 6 replaced with a sinapoyl moiety.
Last Modified2 September 2013
Submittermwilliams
DownloadsMolfile
FormulaC34H34O16
Net Charge0
Average Mass698.630
Monoisotopic Mass698.18469
SMILESCOc1cc(/C=C/C(=O)OC[C@H]2OC(Oc3cc(O)c4c(=O)cc(-c5cc(OC)c(O)c(OC)c5)oc4c3)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O
InChIInChI=1S/C34H34O16/c1-43-22-7-15(8-23(44-2)29(22)38)5-6-27(37)47-14-26-31(40)32(41)33(42)34(50-26)48-17-11-18(35)28-19(36)13-20(49-21(28)12-17)16-9-24(45-3)30(39)25(10-16)46-4/h5-13,26,31-35,38-42H,14H2,1-4H3/b6-5+/t26-,31-,32+,33-,34?/m1/s1
InChIKeyXVUNCAZNCGHDHS-XICCDIAPSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
tricin 7-O-[sinapoyl]-glucoside (CHEBI:75353) has functional parent trans-sinapic acid (CHEBI:15714)
tricin 7-O-[sinapoyl]-glucoside (CHEBI:75353) has functional parent tricin 7-O-glucoside (CHEBI:75349)
tricin 7-O-[sinapoyl]-glucoside (CHEBI:75353) has role metabolite (CHEBI:25212)
tricin 7-O-[sinapoyl]-glucoside (CHEBI:75353) is a D-glucoside (CHEBI:35436)
tricin 7-O-[sinapoyl]-glucoside (CHEBI:75353) is a cinnamate ester (CHEBI:36087)
tricin 7-O-[sinapoyl]-glucoside (CHEBI:75353) is a dihydroxyflavone (CHEBI:38686)
tricin 7-O-[sinapoyl]-glucoside (CHEBI:75353) is a dimethoxyflavone (CHEBI:23798)
tricin 7-O-[sinapoyl]-glucoside (CHEBI:75353) is a glycosyloxyflavone (CHEBI:50018)
tricin 7-O-[sinapoyl]-glucoside (CHEBI:75353) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name 
5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-D-glucopyranoside