Details of Thalirugidine
| IUPAC | (1S)-1-[[4-[5-[[(1S)-5-hydroxy-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol |
| Canonical Smiles | CN1CCC2=C(C(=C(C=C2[C@@H]1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)C[C@H]5C6=CC(=C(C(=C6CCN5C)O)OC)OC)OC)OC)OC)O |
| Inchi | DITCAWDOTGUOAZ-CONSDPRKSA-N |
| PubChem ID | 44584027 |
| Smiles | COc1ccc(C[C@H]2c3cc(OC)c(OC)c(O)c3CCN2C)cc1Oc1ccc(C[C@H]2c3cc(OC)c(OC)c(O)c3CCN2C)cc1 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COc1ccc%28C%5BC%40H%5D2c3cc%28OC%29c%28OC%29c%28O%29c3CCN2C%29cc1Oc1ccc%28C%5BC%40H%5D2c3cc%28OC%29c%28OC%29c%28O%29c3CCN2C%29cc1/file?format=sdf&get3d=True -- COc1ccc%28C%5BC%40H%5D2c3cc%28OC%29c%28OC%29c%28O%29c3CCN2C%29cc1Oc1ccc%28C%5BC%40H%5D2c3cc%28OC%29c%28OC%29c%28O%29c3CCN2C%29cc1 could not be loaded.
| Class | Isoquinoline alkaloids, Tetrahydroisoquinoline alkaloids |
| Super Class | Tyrosine alkaloids |
| Pathways | Alkaloids |
