| Name |
Cyanidin 3-(6''-(E)-p-coumarylsambubioside)-5-glucoside |
| Formula |
C41H45O22 |
| Mw |
889.24024813 |
| CAS RN |
139906-05-1 |
| C_ID |
C00006836
, 
|
| InChIKey |
JSYDBTWJIIAZPU-UHFFFAOYNA-O |
| InChICode |
InChI=1S/C41H44O22/c42-13-27-31(50)33(52)36(55)40(61-27)59-25-11-19(44)10-24-20(25)12-26(37(58-24)17-4-7-21(45)22(46)9-17)60-41-38(63-39-35(54)30(49)23(47)14-57-39)34(53)32(51)28(62-41)15-56-29(48)8-3-16-1-5-18(43)6-2-16/h1-12,23,27-28,30-36,38-42,47,49-55H,13-15H2,(H3-,43,44,45,46,48)/p+1/t23-,27+,28+,30-,31+,32+,33-,34+,35-,36+,38+,39-,40+,41+/m0/s1 |
| SMILES |
O=C(/C=C/c1ccc(O)cc1)OCC1OC(Oc2cc3c(OC4OC(CO)C(O)C(O)C4O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)C(OC2OCC(O)C(O)C2O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Adoxaceae | Sambucus canadensis  | Ref. |
|
|
zoom in
|
