Thiocholchicine
From DrugPedia: A Wikipedia for Drug discovery
| Thiocholchicine
| |
| Systematic (IUPAC) name | |
| N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[d]heptalen-7-yl]acetamide | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C22H25NO5S |
| Mol. mass | 415.5026 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
[edit] Description
Thiocholchicine, pharmaceutical compositions containing them and to the use thereof for the preparation of medicaments with muscle relaxant and anti-inflammatory activities.
[edit] General Properties
*Molecular Weight
415.5026
*Molecular Formula
C22H25NO5S
*IUPAC NAME
N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[d]heptalen-7-yl]acetamide
*Canonical Smiles
CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC
*Isomeric Smiles
CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC
*XLogP
1.9
*Topological Polar Surface Area
73.9
