BIAdb Ethylester berbine 2150
From DrugPedia: A Wikipedia for Drug discovery
| BIAdb Ethylester berbine 2150
| |
| Systematic (IUPAC) name | |
| ethyl2,3-dimethoxy-11-oxo-6,8,9,10,13,13a-hexahydro-5H-isoquinolino[3,2-a]isoquinoline-8a-carboxylate | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C22H27NO5 |
| Mol. mass | 385.45348 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
N/A
[edit] Function
Unknown
[edit] General Properties
*Molecular Weight
385.45348
*Exact Mass
385.188923
*Molecular Formula
C22H27NO5
*IUPAC NAME
ethyl2,3-dimethoxy-11-oxo-6,8,9,10,13,13a-hexahydro-5H-isoquinolino[3,2-a]isoquinoline-8a-carboxylate
*Canonical Smiles
CCOC(=O)C12CCC(=O)C=C1CC3C4=CC(=C(C=C4CCN3C2)OC)OC
*Isomeric Smiles
N/A
*XLogP
1.8
*Hydrogen bond donor
0
*Hydrogen bond acceptor
6
*Rotational Bond Count
5
*Topological Polar Surface Area
65.1
