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CHEBI:186131 - 2'''-O-Rhamnosyl-2''-O-glucosylcytisoside

ChEBI IDCHEBI:186131
ChEBI Name2'''-O-Rhamnosyl-2''-O-glucosylcytisoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H42O19
Net Charge0
Average Mass754.691
Monoisotopic Mass754.23203
SMILES[H][C@@]1(c2c(O)cc(O)c3c(=O)cc(-c4ccc(OC)cc4)oc23)OC(CO)[C@@H](O)[C@H](O)C1O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O[C@@H]1OC(C)[C@H](O)C(O)[C@@H]1O
InChIInChI=1S/C34H42O19/c1-11-22(40)25(43)28(46)33(48-11)53-32-27(45)24(42)19(10-36)51-34(32)52-31-26(44)23(41)18(9-35)50-30(31)21-15(38)7-14(37)20-16(39)8-17(49-29(20)21)12-3-5-13(47-2)6-4-12/h3-8,11,18-19,22-28,30-38,40-46H,9-10H2,1-2H3/t11?,18?,19?,22-,23+,24+,25?,26-,27-,28-,30-,31?,32?,33-,34-/m0/s1
InChIKeyAQRHLFGVMFUVHW-FMYSWZNISA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
2'''-O-Rhamnosyl-2''-O-glucosylcytisoside (CHEBI:186131) is a C-glycosyl compound (CHEBI:20857)
2'''-O-Rhamnosyl-2''-O-glucosylcytisoside (CHEBI:186131) is a flavonoids (CHEBI:72544)
IUPAC Name 
8-[(2S,4S,5S)-3-[(2S,4S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one
Manual XrefsDatabases
24843477ChemSpider
LMPK12110438LIPID MAPS