Coptisine
5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-1(13),2,4(8),9,14,16(20),21,23-octaene
| Molecular Formula | C19H14NO4+ |
|---|---|
| Molecular Weight | 320.3 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 40.8 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 320.0923 |
| Heavy Atoms | 24 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 3486-66-6 |
|---|---|
| SMILES | C1C[N+]2=C(C=C3C=CC4=C(C3=C2)OCO4)C5=CC6=C(C=C51)OCO6 |
| InChIKey | XYHOBCMEDLZUMP-UHFFFAOYSA-N |
📖 Product Overview
Coptisine (CAS: 3486-66-6) is a chemical compound with molecular formula C19H14NO4+ and molecular weight 320.3 g/mol. Its IUPAC systematic name is 5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-1(13),2,4(8),9,14,16(20),21,23-octaene.
XYHOBCMEDLZUMP-UHFFFAOYSA-N.
SMILES: C1C[N+]2=C(C=C3C=CC4=C(C3=C2)OCO4)C5=CC6=C(C=C51)OCO6.
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