BIAdb Sinomenine 3219
From DrugPedia: A Wikipedia for Drug discovery
| BIAdb Sinomenine 3219
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C19H23NO4 |
| Mol. mass | 329.39022 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
Sinomenium acutum
[edit] Function
Antirheumatic
[edit] General Properties
*Molecular Weight
329.39022
*Exact Mass
329.162708
*Molecular Formula
C19H23NO4
*IUPAC NAME
N/A
*Canonical Smiles
CN1CCC23CC(=O)C(=CC2C1CC4=C3C(=C(C=C4)OC)O)OC
*Isomeric Smiles
CN1CC[C@@]23CC(=O)C(=C[C@@H]2[C@@H]1CC4=C3C(=C(C=C4)OC)O)OC
*XLogP
2.2
*Hydrogen bond donor
1
*Hydrogen bond acceptor
5
*Rotational Bond Count
2
*Topological Polar Surface Area
59
