Details of ERGOSINE
| IUPAC | (6aR,9R)-N-[(1S,2S,4R,7S)-2-hydroxy-4-methyl-7-(2-methylpropyl)-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide |
| Canonical Smiles | CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O |
| Inchi | NESVMZOPWPCFAU-ZPRCMDFASA-N |
| PubChem ID | 105137 |
| Smiles | CC(C)CC1C(=O)N2CCCC2C2(O)OC(C)(NC(=O)C3=CC4c5cccc6[nH]cc(c56)CC4N(C)C3)C(=O)N12 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC%28C%29CC1C%28%3DO%29N2CCCC2C2%28O%29OC%28C%29%28NC%28%3DO%29C3%3DCC4c5cccc6%5BnH%5Dcc%28c56%29CC4N%28C%29C3%29C%28%3DO%29N12/file?format=sdf&get3d=True -- CC%28C%29CC1C%28%3DO%29N2CCCC2C2%28O%29OC%28C%29%28NC%28%3DO%29C3%3DCC4c5cccc6%5BnH%5Dcc%28c56%29CC4N%28C%29C3%29C%28%3DO%29N12 could not be loaded.
| Class | Ergot alkaloids |
| Super Class | Tryptophan alkaloids |
| Pathways | Alkaloids |