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CHEBI:185106 - 6-Methoxykaempferol 3-rhamnoside-7-(4'''-acetylrhamnoside)

ChEBI IDCHEBI:185106
ChEBI Name6-Methoxykaempferol 3-rhamnoside-7-(4'''-acetylrhamnoside)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H34O16
Net Charge0
Average Mass650.586
Monoisotopic Mass650.18469
SMILESCOc1c(O[C@@H]2O[C@@H](C)[C@H](OC(C)=O)C(O)C2O)cc2oc(-c3ccc(O)cc3)c(O[C@@H]3OC(C)[C@H](O)C(O)[C@@H]3O)c(=O)c2c1O
InChIInChI=1S/C30H34O16/c1-10-18(33)21(36)23(38)30(41-10)46-28-20(35)17-15(44-26(28)13-5-7-14(32)8-6-13)9-16(27(40-4)19(17)34)45-29-24(39)22(37)25(11(2)42-29)43-12(3)31/h5-11,18,21-25,29-30,32-34,36-39H,1-4H3/t10?,11-,18-,21?,22?,23-,24?,25-,29-,30-/m0/s1
InChIKeyQSIIEBFTXYATML-PKMUABMXSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
6-Methoxykaempferol 3-rhamnoside-7-(4'''-acetylrhamnoside) (CHEBI:185106) is a flavonoids (CHEBI:72544)
6-Methoxykaempferol 3-rhamnoside-7-(4'''-acetylrhamnoside) (CHEBI:185106) is a glycoside (CHEBI:24400)
IUPAC Name 
[(2S,3R,6S)-4,5-dihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-4-oxo-3-[(2S,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-7-yl]oxy-2-methyloxan-3-yl] acetate
Manual XrefsDatabases
24845459ChemSpider
LMPK12112844LIPID MAPS