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CHEBI:192836 - Kaempferol 3-(2''-(Z)-p-coumaroylrhamnoside)

ChEBI IDCHEBI:192836
ChEBI NameKaempferol 3-(2''-(Z)-p-coumaroylrhamnoside)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H26O12
Net Charge0
Average Mass578.526
Monoisotopic Mass578.14243
SMILESCC1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@@H](OC(=O)/C=C\c2ccc(O)cc2)C(O)[C@H]1O
InChIInChI=1S/C30H26O12/c1-14-24(36)26(38)29(41-22(35)11-4-15-2-7-17(31)8-3-15)30(39-14)42-28-25(37)23-20(34)12-19(33)13-21(23)40-27(28)16-5-9-18(32)10-6-16/h2-14,24,26,29-34,36,38H,1H3/b11-4-/t14?,24-,26?,29-,30-/m0/s1
InChIKeyXTSAKAIOOOOJPS-MVWDQYGTSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS3183) Strain: Cryptomeria fortunei Hooibrenk
ChEBI Ontology
Outgoing Relation(s)
Kaempferol 3-(2''-(Z)-p-coumaroylrhamnoside) (CHEBI:192836) is a flavonoids (CHEBI:72544)
Kaempferol 3-(2''-(Z)-p-coumaroylrhamnoside) (CHEBI:192836) is a glycoside (CHEBI:24400)
IUPAC Name 
[(2S,3S,5R)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl] (Z)-3-(4-hydroxyphenyl)prop-2-enoate
Manual XrefsDatabases
LMPK12111938LIPID MAPS
24844680ChemSpider