| Name |
Cyanidin 3,3'-di-glucoside-7-(6''-caffeoylglucoside) |
| Formula |
C42H47O24 |
| Mw |
935.24572743 |
| CAS RN |
215176-97-9 |
| C_ID |
C00014764
, 
|
| InChIKey |
YVKLONZWAFCIAE-YFOHSEPSNA-O |
| InChICode |
InChI=1S/C42H46O24/c43-12-26-30(50)33(53)37(57)41(64-26)62-24-8-16(3-5-20(24)46)39-25(63-42-38(58)34(54)31(51)27(13-44)65-42)11-18-21(47)9-17(10-23(18)61-39)60-40-36(56)35(55)32(52)28(66-40)14-59-29(49)6-2-15-1-4-19(45)22(48)7-15/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)CO)O)O)O)c1cc(c(cc1)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)COC(=O)/C=C/c1cc(c(cc1)O)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Orchidaceae | Sophronitis coccinea | Ref. |
|
|
zoom in
| Organism | Sophronitis coccinea |
|---|
| Reference | Tatsuzawa,Phytochem.,49,(1998),869 |
|---|
|
