Canadine
From DrugPedia: A Wikipedia for Drug discovery
| Canadine
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C20H21NO4 |
| Mol. mass | 339.38504 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
[edit] Description
RN given refers to cpd without isomeric designation; structure, Berberis diisoquinoline alkaloid
[edit] General Properties
*Molecular Weight
339.38504
*Molecular Formula
C20H21NO4
*IUPAC NAME
N/A
*Canonical Smiles
COC1=C(C2=C(CC3C4=CC5=C(C=C4CCN3C2)OCO5)C=C1)OC
*Isomeric Smiles
COC1=C(C2=C(C[C@H]3C4=CC5=C(C=C4CCN3C2)OCO5)C=C1)OC
*XLogP
2.6
*Topological Polar Surface Area
40.2
