Columbamine
3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-ol
| Molecular Formula | C20H20NO4+ |
|---|---|
| Molecular Weight | 338.4 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 51.8 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.13922 |
| Heavy Atoms | 25 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 3621-36-1 |
|---|---|
| SMILES | COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)O)OC |
| InChIKey | YYFOFDHQVIODOQ-UHFFFAOYSA-O |
📖 Product Overview
Columbamine (CAS: 3621-36-1) is a chemical compound with molecular formula C20H20NO4+ and molecular weight 338.4 g/mol. Its IUPAC systematic name is 3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-ol.
YYFOFDHQVIODOQ-UHFFFAOYSA-O.
SMILES: COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)O)OC.
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