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CHEBI:191725 - 7-O-(4-Hydroxycinnamoyl) astragalin

ChEBI IDCHEBI:191725
ChEBI Name7-O-(4-Hydroxycinnamoyl) astragalin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H26O13
Net Charge0
Average Mass594.525
Monoisotopic Mass594.13734
SMILESO=C(/C=C/c1ccc(O)cc1)Oc1cc(O)c2c(=O)c(OC3OC(CO)C(O)C(O)C3O)c(-c3ccc(O)cc3)oc2c1
InChIInChI=1S/C30H26O13/c31-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(40-22(35)10-3-14-1-6-16(32)7-2-14)12-20(23)41-28(29)15-4-8-17(33)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2/b10-3+
InChIKeyCAHLQXBTMALBQE-XCVCLJGOSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
seed (BTO:0001226) MetaboLights (MTBLS4572)
bark (BTO:0001301) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
7-O-(4-Hydroxycinnamoyl) astragalin (CHEBI:191725) is a flavonoids (CHEBI:72544)
7-O-(4-Hydroxycinnamoyl) astragalin (CHEBI:191725) is a glycoside (CHEBI:24400)
IUPAC Name 
[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-7-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Manual XrefsDatabases
HMDB0040473HMDB