| Name |
beta2-Tomatine |
| Formula |
C44H73NO16 |
| Mw |
871.49293529 |
| CAS RN |
17406-47-2 |
| C_ID |
C00055736
|
| InChIKey |
OOXSVXSQCBGCTK-UHFFFAOYSA-N |
| InChICode |
InChI=1S/C44H73NO16/c1-19-7-12-44(45-15-19)20(2)30-27(61-44)14-25-23-6-5-21-13-22(8-10-42(21,3)24(23)9-11-43(25,30)4)56-40-35(53)33(51)37(29(17-47)58-40)59-41-36(54)38(32(50)28(16-46)57-41)60-39-34(52)31(49)26(48)18-55-39/h19-41,45-54H,5-18H2,1-4H3 |
| SMILES |
CC1C2(NCC(C)CC2)OC3CC4C(C5CCC4(C)C31)CCC(C5(C)CC6)CC6OC7OC(CO)C(OC8C(O)C(OC9C(O)C(O)C(O)CO9)C(O)C(CO)O8)C(O)C7O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Solanaceae | Solanum lycopersicum  | Ref. |
|
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