| Name |
3-Caffeoylpelargonidin 5-glucoside |
| Formula |
C30H27O13+ |
| Mw |
595.14516595 |
| CAS RN |
100595-03-7 |
| C_ID |
C00054687
|
| InChIKey |
KYTVPWHUQGWZRC-SHPGVJHPSA-O |
| InChICode |
InChI=1S/C30H26O13/c31-13-24-26(37)27(38)28(39)30(43-24)42-22-11-17(33)10-21-18(22)12-23(29(41-21)15-3-5-16(32)6-4-15)40-25(36)8-2-14-1-7-19(34)20(35)9-14/h1-12,24,26-28,30-31,37-39H,13H2,(H3-,32,33,34,35,36)/p+1/t24-,26-,27+,28-,30-/m1/s1 |
| SMILES |
O=C(/C=C/c1ccc(O)c(O)c1)Oc1cc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)cc2[o+]c1-c1ccc(O)cc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cruciferae | Raphanus sp. | Ref. |
|
|
zoom in
| Organism | Raphanus sp. |
|---|
| Reference | Karrer, P. et al., Helv. Chim. Acta, 1927, 10, 67
1928, 12, 292 (isol, Monardein) |
|---|
|
