Details of NEOPELLINE
| IUPAC | [(1S,2R,3R,4S,5R,6S,8R,9R,10R,13S,17R,18R)-8-acetyloxy-11-ethyl-16-hydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate |
| Canonical Smiles | CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6CC4C5C6OC(=O)C7=CC=CC=C7)OC)OC(=O)C)OC)O)COC |
| Inchi | XLRLDVRIQBZJPD-OQQNHCLFSA-N |
| PubChem ID | 101289530 |
| Smiles | CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC(C)=O)(C5C6OC(=O)c5ccccc5)C(C(OC)C23)C14 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CCN1CC2%28COC%29CCC%28O%29C34C5CC6C%28OC%29CC%28OC%28C%29%3DO%29%28C5C6OC%28%3DO%29c5ccccc5%29C%28C%28OC%29C23%29C14/file?format=sdf&get3d=True -- CCN1CC2%28COC%29CCC%28O%29C34C5CC6C%28OC%29CC%28OC%28C%29%3DO%29%28C5C6OC%28%3DO%29c5ccccc5%29C%28C%28OC%29C23%29C14 could not be loaded.
| Class | |
| Super Class | |
| Pathways |
