| Name |
Cyanidin 3-[6-(3-glucosylcaffeyl)glucoside]-5-glucoside |
| Formula |
C42H47O24 |
| Mw |
935.24572743 |
| CAS RN |
|
| C_ID |
C00006828
, 
|
| InChIKey |
QJCCYVIQLKHDMG-LYNOESRONA-O |
| InChICode |
InChI=1S/C42H46O24/c43-12-26-30(50)33(53)36(56)40(64-26)61-23-10-17(45)9-22-18(23)11-25(39(60-22)16-3-5-19(46)21(48)8-16)63-42-38(58)35(55)32(52)28(66-42)14-59-29(49)6-2-15-1-4-20(47)24(7-15)62-41-37(57)34(54)31(51)27(13-44)65-41/h1-11,26-28,30-38,40-44,50-58H,12-14H2,(H3-,45,46,47,48,49)/p+1/t26-,27+,28-,30-,31-,32-,33+,34+,35-,36-,37-,38-,40-,41-,42-/m1/s1 |
| SMILES |
c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)COC(=O)/C=C/c1ccc(c(c1)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)O)O)O)O)c1ccc(c(c1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Convolvulaceae | Ipomoea nil  | Ref. |
|
|
zoom in
| Organism | Ipomoea nil |
|---|
| Reference | Harborne, The Handbook of Natural Flavonoids, 2, (1999), 1,Anthocyanins
Saito,Phytochem.,41,(1996),1607 |
|---|
|
