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CHEBI:192850 - Rhamnocitrin 3-(5'''-p-coumarylapiosyl)-(1->2)-glucoside

Default Structure
ChEBI IDCHEBI:192850
ChEBI NameRhamnocitrin 3-(5'''-p-coumarylapiosyl)-(1->2)-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H36O17
Net Charge0
Average Mass740.667
Monoisotopic Mass740.19525
SMILESCOc1cc(O)c2c(=O)c(O[C@@H]3OC(CO)[C@@H](O)C(O)C3O[C@@H]3OCC(O)(COC(=O)/C=C/c4ccc(O)cc4)[C@@H]3O)c(-c3ccc(O)cc3)oc2c1
InChIInChI=1S/C36H36O17/c1-47-21-12-22(40)26-23(13-21)50-30(18-5-9-20(39)10-6-18)31(28(26)43)52-34-32(29(44)27(42)24(14-37)51-34)53-35-33(45)36(46,16-49-35)15-48-25(41)11-4-17-2-7-19(38)8-3-17/h2-13,24,27,29,32-35,37-40,42,44-46H,14-16H2,1H3/b11-4+/t24?,27-,29?,32?,33-,34+,35+,36?/m1/s1
InChIKeyUWRVNAYXPMAZQA-BWXOFBLZSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS3183) Strain: Cryptomeria fortunei Hooibrenk
ChEBI Ontology
Outgoing Relation(s)
Rhamnocitrin 3-(5'''-p-coumarylapiosyl)-(1->2)-glucoside (CHEBI:192850) is a flavonoids (CHEBI:72544)
Rhamnocitrin 3-(5'''-p-coumarylapiosyl)-(1->2)-glucoside (CHEBI:192850) is a glycoside (CHEBI:24400)
IUPAC Name 
[(4S,5S)-5-[(2S,5S)-4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-3-yl]oxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxolan-3-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
Manual XrefsDatabases
24845242ChemSpider
LMPK12112569LIPID MAPS