Bisnordihydrotoxiferine
From DrugPedia: A Wikipedia for Drug discovery
(Difference between revisions)
m (1 revision) |
(→External Links) |
||
| Line 60: | Line 60: | ||
[http://crdd.osdd.net/raghava/biadb/detail.php?id=2017 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=2017 Link to BIAdb Database] | ||
| + | [[Category:BIAdb]] | ||
Revision as of 11:46, 10 December 2009
| Bisnordihydrotoxiferine
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C38H40N4 |
| Mol. mass | 552.751 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Description
from Strychnos trinervis root bark; structure given in first source
General Properties
*Molecular Weight
552.751
*Molecular Formula
C38H40N4
*IUPAC NAME
N/A
*Canonical Smiles
CC=C1CN2CCC34C2CC1C5=CN6C7C(=CN(C53)C8=CC=CC=C48)C9CC1C7(CCN1CC9=CC)C1=CC=CC=C16
*Isomeric Smiles
CC=C/1CN2CCC34C2CC1/C/5=C/N6C7/C(=CN(C53)C8=CC=CC=C48)/C9CC1C7(CCN1C/C9=C/C)C1=CC=CC=C16
*XLogP
4.3
*Topological Polar Surface Area
13
