| Name |
Cyanidin-3-o-(2′′-o-xylosyl)rutinoside |
| Alternative name |
Cyanidin 3-(2G-xylosylrutinoside) |
| Formula |
C32H39O19+ |
| Formula Weight |
727.60 g/mol |
| Molecular Weight |
727.60 g/mol |
| Monoisotopic Mass |
727.209000 g/mol |
| InChI Key |
ZSWXIMXLLJRVFT-HGUBBEBESA-O |
| IUPAC |
(2R,4S,5R)-2-[[(3S,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-3,4-dihydroxy-5-[(2S,3R,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol |
| InChI |
InChI=1S/C33H40O20/c1-10-21(39)24(42)27(45)31(48-10)47-9-20-23(41)26(44)30(53-32-28(46)25(43)22(40)19(8-34)51-32)33(52-20)50-18-7-13-15(37)5-12(35)6-17(13)49-29(18)11-2-3-14(36)16(38)4-11/h2-7,10,19-28,30-34,39-46H,8-9H2,1H3,(H3-,35,36,37,38)/p+1 |
| SMILES |
CC1OC(OCC2OC(OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC=C(O)C(O)=C3)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |