Details of Roxburghine
| IUPAC | methyl 2-methyl-4,14,21,31-tetrazaoctacyclo[15.15.0.02,14.03,11.05,10.019,31.020,28.022,27]dotriaconta-3(11),5,7,9,15,20(28),22,24,26-nonaene-16-carboxylate |
| Canonical Smiles | CC12C3CN4CCC5=C(C4CC3C(=CN1CCC6=C2NC7=CC=CC=C67)C(=O)OC)NC8=CC=CC=C58 |
| Inchi | SHKMVIVFLHPOSB-UHFFFAOYSA-N |
| PubChem ID | 324225 |
| Smiles | COC(=O)C1=CN2CCc3c([nH]c4ccccc34)C2(C)C2CN3CCc4c([nH]c5ccccc45)C3CC12 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COC%28%3DO%29C1%3DCN2CCc3c%28%5BnH%5Dc4ccccc34%29C2%28C%29C2CN3CCc4c%28%5BnH%5Dc5ccccc45%29C3CC12/file?format=sdf&get3d=True -- COC%28%3DO%29C1%3DCN2CCc3c%28%5BnH%5Dc4ccccc34%29C2%28C%29C2CN3CCc4c%28%5BnH%5Dc5ccccc45%29C3CC12 could not be loaded.
| Class | Corynanthe type |
| Super Class | Tryptophan alkaloids |
| Pathways | Alkaloids |
