Details of Berbamunine
| IUPAC | (1S)-1-[[4-[2-hydroxy-5-[[(1R)-7-hydroxy-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]phenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol |
| Canonical Smiles | CN1CCC2=CC(=C(C=C2[C@@H]1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)O)O)O)OC |
| Inchi | FDABVSXGAMFQQH-XZWHSSHBSA-N |
| PubChem ID | 440585 |
| Smiles | COc1cc2c(cc1O)[C@H](Cc1ccc(Oc3cc(C[C@@H]4c5cc(O)c(OC)cc5CCN4C)ccc3O)cc1)N(C)CC2 |
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| Class | Isoquinoline alkaloids, Tetrahydroisoquinoline alkaloids |
| Super Class | Tyrosine alkaloids |
| Pathways | Alkaloids |
