| Name |
6-O-Nicotinoyl-7-O-acetylscutebarbatine G |
| Formula |
C34H38N2O9 |
| Mw |
618.25773083 |
| CAS RN |
960302-85-6 |
| C_ID |
C00029582
, 
|
| InChIKey |
MCZQKBCMIDJMDT-ZLQFDLEQNA-N |
| InChICode |
InChI=1S/C34H38N2O9/c1-20-9-6-12-24-31(20,3)27(44-30(40)23-11-8-14-36-18-23)28(42-21(2)37)33(5)32(24,4)25(15-34(45-33)16-26(38)41-19-34)43-29(39)22-10-7-13-35-17-22/h7-11,13-14,17-18,24-25,27-28H,6,12,15-16,19H2,1-5H3/t24-,25-,27-,28-,31-,32-,33-,34-/m0/s1 |
| SMILES |
C1C=C([C@]2([C@H](C1)[C@@]1([C@]([C@H]([C@@H]2OC(=O)c2cnccc2)OC(=O)C)(O[C@@]2(C[C@@H]1OC(=O)c1cccnc1)CC(=O)OC2)C)C)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Asp L-His |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Scutellaria barbata D.DON  | Ref. |
|
|
zoom in
|
