Buprenorphine-d4
From DrugPedia: A Wikipedia for Drug discovery
(Difference between revisions)
m (1 revision) |
(→External Links) |
||
| (One intermediate revision not shown.) | |||
| Line 60: | Line 60: | ||
[http://crdd.osdd.net/raghava/biadb/detail.php?id=2068 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=2068 Link to BIAdb Database] | ||
| + | [[Category:BIAdb_old]] | ||
Current revision
| Buprenorphine-d4
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C29H41NO4 |
| Mol. mass | 471.664787 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
[edit] Description
[edit] General Properties
*Molecular Weight
471.664787
*Molecular Formula
C29H41NO4
*IUPAC NAME
N/A
*Canonical Smiles
CC(C)(C)C(C)(C1CC23CCC1(C4C25CCN(C3CC6=C5C(=C(C=C6)O)O4)CC7CC7)OC)O
*Isomeric Smiles
[2H]C1(CC1C([2H])([2H])N2CC[C@]34[C@@H]5C6(CC[C@]3([C@H]2CC7=C4C(=C(C=C7)O)O5)C[C@@H]6[C@@](C)(C(C)(C)C)O)OC)[2H]
*XLogP
3.8
*Topological Polar Surface Area
62.2
