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cyanidin 3-glucosyl-rutinoside


Name(s) cyanidin 3-glucosyl-rutinoside
Scientific name(s)
Formula C33H41O20
Molecular mass 757.6666
IUPAC name 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1$l^{4}-chromen-1-ylium
INCHI InChI=1S/C33H40O20/c1-10-21(38)24(41)27(44)31(49-10)47-8-19-22(39)25(42)28(45)32(52-19)48-9-20-23(40)26(43)29(46)33(53-20)51-18-7-13-15(36)5-12(34)6-17(13)50-30(18)11-2-3-14(35)16(37)4-11/h2-7,10,19-29,31-33,38-46H,8-9H2,1H3,(H3-,34,35,36,37)/p+1/t10-,19+,20+,21-,22+,23+,24+,25-,26-,27+,28+,29+,31+,32+,33+/m0/s1
SMILE C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC[C@H]3O[C@@H](OC4=CC5=C(C=C(O)C=C5O)[O+]=C4C4=CC(O)=C(O)C=C4)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
CAS ID Not available
PubChem ID Not available
DrugBank ID Not available
CHEBI ID Not available
Description Cyanidin 3-rhamnosyl-glucosyl-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Cyanidin 3-rhamnosyl-glucosyl-glucoside can be found in asparagus and olive, which makes cyanidin 3-rhamnosyl-glucosyl-glucoside a potential biomarker for the consumption of these food products.