Details of Neferine
| IUPAC | 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol |
| Canonical Smiles | CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC |
| Inchi | MIBATSHDJRIUJK-ROJLCIKYSA-N |
| PubChem ID | 159654 |
| Smiles | COc1ccc(CC2c3cc(Oc4cc(CC5c6cc(OC)c(OC)cc6CCN5C)ccc4O)c(OC)cc3CCN2C)cc1 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COc1ccc%28CC2c3cc%28Oc4cc%28CC5c6cc%28OC%29c%28OC%29cc6CCN5C%29ccc4O%29c%28OC%29cc3CCN2C%29cc1/file?format=sdf&get3d=True -- COc1ccc%28CC2c3cc%28Oc4cc%28CC5c6cc%28OC%29c%28OC%29cc6CCN5C%29ccc4O%29c%28OC%29cc3CCN2C%29cc1 could not be loaded.
| Class | Isoquinoline alkaloids, Isoquinoline alkaloids |
| Super Class | Tyrosine alkaloids |
| Pathways | Alkaloids |