| Name |
Tabernamine |
| Formula |
C40H48N4O2 |
| Mw |
616.37772681 |
| CAS RN |
59626-92-5 |
| C_ID |
C00001771
, 
|
| InChIKey |
MTARGWPMLJBYNG-PAYZPCECNA-N |
| InChICode |
InChI=1S/C40H48N4O2/c1-5-23-15-22-16-32-37-28(13-14-44(20-22)39(23)32)27-12-11-25(17-34(27)42-37)30-18-29-24(6-2)21-43(3)35(36(29)40(45)46-4)19-31-26-9-7-8-10-33(26)41-38(30)31/h6-12,17,22-23,29-30,32,35-36,39,41-42H,5,13-16,18-21H2,1-4H3/b24-6-/t22-,23+,29-,30-,32+,35-,36+,39+/m1/s1 |
| SMILES |
[nH]1c2c(c3c1cc(cc3)[C@H]1C[C@H]3[C@@H]([C@@H](Cc4c1[nH]c1c4cccc1)N(C/C/3=C/C)C)C(=O)OC)CCN1[C@@H]3[C@H]2C[C@@H](C[C@@H]3CC)C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apocynaceae | Tabernaemontana johnstonii | Ref. |
|
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