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CHEBI:168393 - 5,7,4'-Trihydroxy-3'-C-methylflavone 4'-rhamnoside

ChEBI IDCHEBI:168393
ChEBI Name5,7,4'-Trihydroxy-3'-C-methylflavone 4'-rhamnoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H22O9
Net Charge0
Average Mass430.409
Monoisotopic Mass430.12638
SMILESCc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O[C@@H]1OC(C)[C@H](O)C(O)[C@@H]1O
InChIInChI=1S/C22H22O9/c1-9-5-11(16-8-14(25)18-13(24)6-12(23)7-17(18)30-16)3-4-15(9)31-22-21(28)20(27)19(26)10(2)29-22/h3-8,10,19-24,26-28H,1-2H3/t10?,19-,20?,21-,22-/m0/s1
InChIKeyHODFNPWFPIJZLC-NGRAZTOXSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
5,7,4'-Trihydroxy-3'-C-methylflavone 4'-rhamnoside (CHEBI:168393) is a flavonoids (CHEBI:72544)
5,7,4'-Trihydroxy-3'-C-methylflavone 4'-rhamnoside (CHEBI:168393) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-2-[3-methyl-4-[(2S,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]chromen-4-one
Manual XrefsDatabases
LMPK12110332LIPID MAPS
24843386ChemSpider