| Name |
Jesaconitine |
| Formula |
C35H49NO12 |
| Mw |
675.32547604 |
| CAS RN |
16298-90-1 |
| C_ID |
C00001648
, 
|
| InChIKey |
MGTJNQWIXFSPLC-OEYKFGNZNA-N |
| InChICode |
InChI=1S/C35H49NO12/c1-8-36-15-32(16-42-3)21(38)13-22(44-5)34-20-14-33(41)29(47-31(40)18-9-11-19(43-4)12-10-18)23(20)35(48-17(2)37,28(39)30(33)46-7)24(27(34)36)25(45-6)26(32)34/h9-12,20-30,38-39,41H,8,13-16H2,1-7H3/t20-,21-,22+,23-,24+,25-,26-,27-,28+,29-,30+,32+,33-,34+,35+/m1/s1 |
| SMILES |
C([C@]12[C@@H]3[C@@]4([C@H](C[C@H]1O)OC)[C@H]1[C@H]5[C@]([C@@H]([C@H]3OC)[C@H]4N(C2)CC)([C@H]([C@@H]([C@]([C@@H]5OC(=O)c2ccc(cc2)OC)(C1)O)OC)O)OC(=O)C)OC |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp L-Tyr Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Ranunculaceae | Aconitum fischeri | Ref. |
| Plantae | Ranunculaceae | Aconitum sachalinense | Ref. |
| Plantae | Ranunculaceae | Aconitum subcuneatum | Ref. |
|
|
zoom in
| Organism | Aconitum sachalinense |
|---|
| Reference | Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter19 |
|---|
|
