| Name |
11-Demethylconoduramine |
| Formula |
C42H50N4O5 |
| Mw |
690.37812074 |
| CAS RN |
95066-49-2 |
| C_ID |
C00025709
, 
|
| InChIKey |
MWTHBNIWYPKNEY-HCBMXOAHNA-N |
| InChICode |
InChI=1S/C42H50N4O5/c1-6-23-14-22-19-42(41(49)51-5)38-26(12-13-46(20-22)39(23)42)28-16-29(35(47)18-33(28)44-38)30-15-27-24(7-2)21-45(3)34(36(27)40(48)50-4)17-31-25-10-8-9-11-32(25)43-37(30)31/h7-11,16,18,22-23,27,30,34,36,39,43-44,47H,6,12-15,17,19-21H2,1-5H3/b24-7+/t22-,23+,27-,30-,34-,36-,39+,42+/m0/s1 |
| SMILES |
[C@@H]12CN3[C@@H]([C@](c4[nH]c5cc(c([C@@H]6C[C@@H]7[C@@H]([C@H](Cc8c6[nH]c6c8cccc6)N(C)C/C/7=C\C)C(=O)OC)cc5c4CC3)O)(C1)C(=O)OC)[C@@H](C2)CC |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apocynaceae | Tabernaemontana pachysiphon Stapf.  | Ref. |
|
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