| Name |
Neoipecoside |
| Formula |
C27H35NO12 |
| Mw |
565.21592559 |
| CAS RN |
122587-76-2 |
| C_ID |
C00028669
, 
|
| InChIKey |
XNYSLIQSJYSIDP-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C27H35NO12/c1-4-14-15(9-17-20-13(5-6-18(31)21(20)32)7-8-28(17)12(2)30)16(25(36)37-3)11-38-26(14)40-27-24(35)23(34)22(33)19(10-29)39-27/h4-6,11,14-15,17,19,22-24,26-27,29,31-35H,1,7-10H2,2-3H3/t14-,15-,17+,19+,22+,23-,24+,26+,27-/m0/s1 |
| SMILES |
c1(ccc2c(c1O)[C@H](N(CC2)C(=O)C)C[C@@H]1C(=CO[C@@H]([C@H]1C=C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C(=O)OC)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rubiaceae | Cephaelis ipecacuanha  | Ref. |
|
|
zoom in
|
