| Name |
Roxburghine B |
| Formula |
C31H32N4O2 |
| Mw |
492.25252629 |
| CAS RN |
27932-46-3 |
| C_ID |
C00001765
, 
|
| InChIKey |
SSVINUXCSDCQPY-IAHYDSCGNA-N |
| InChICode |
InChI=1S/C31H32N4O2/c1-31-14-27-22(19-8-4-5-9-25(19)32-27)15-35(31)16-23(30(36)37-2)21-13-28-29-20(11-12-34(28)17-24(21)31)18-7-3-6-10-26(18)33-29/h3-10,16,21,24,28,32-33H,11-15,17H2,1-2H3/t21-,24-,28-,31+/m1/s1 |
| SMILES |
COC(=O)C1=CN2Cc3c([nH]c4ccccc34)C[C@@]2(C)[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@H]3C[C@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rubiaceae | Uncaria gambir  | Ref. |
|
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