Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside

Molecular Formula: C₃₅H₄₅O₁₈⁺

InChI: InChI=1/C35H44O18/c1-12-23(10-36)52-33(13(2)25(12)40)50-21-8-16(37)7-20-17(21)9-22(32(49-20)15-4-5-18(38)19(39)6-15)51-35-31(46)29(44)27(42)24(53-35)11-47-34-30(45)28(43)26(41)14(3)48-34/h4-9,12-14,23-31,33-36,40-46H,10-11H2,1-3H3,(H2-,37,38,39)/p+1/t12-,13-,14+,23-,24-,25+,26+,27-,28-,29+,30-,31-,33-,34-,35-/m1/s1/fC35H45O18/h37-39H/q+1

InChIKey: InChIKey=LFVQFVIMSXBCOT-JIVVKIDBDX
SMILES: C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc4c(O[C@@H]5O[C@H](CO)[C@@H](C)[C@H](O)[C@H]5C)cc(O)cc4[o+]c3-c6ccc(O)c(O)c6)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O

Names:
    CHEBI:16596
    Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside
    cyanidin 3-O-rutinoside 5-O-beta-D-glucoside
    cyanidin 3-O-rutinoside 5-O-β-D-glucoside
    (2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-7-hydroxy-5-[(2S,3R,4S,5S,6R)-4-hydroxy-6-(hydroxymethyl)-3,5-dimethyl-oxan-2-yl]oxy-chromen-3-yl]oxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxymethyl]oxane-3,4,5-triol
    3-[6-deoxy-alpha-L-mannopyranosyl-(1->6)-beta-D-glucopyranosyloxy]-2-(3,4-dihydroxyphenyl)-7-hydroxychromenium-5-yl beta-D-glucopyranoside
    3-[6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyloxy]-2-(3,4-dihydroxyphenyl)-7-hydroxychromenium-5-yl beta-D-glucopyranoside
    3-[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyloxy]-2-

Registries:
    PubChem CID 11966215
    ChEBI 16596
    Kegg C12646
    PubChem ID 17425123
    PubChem ID 583036