Buprenorphine-O3-glucuronide

From DrugPedia: A Wikipedia for Drug discovery

(Difference between revisions)
Jump to: navigation, search
(External Links)
Current revision (04:34, 11 December 2009) (edit) (undo)
(External Links)
 
Line 60: Line 60:
[http://crdd.osdd.net/raghava/biadb/detail.php?id=2003 Link to BIAdb Database]
[http://crdd.osdd.net/raghava/biadb/detail.php?id=2003 Link to BIAdb Database]
-
[[Category:BIAdb]]
+
[[Category:BIAdb_old]]

Current revision

Show 3-D Structure

Show 2-D Structure

Buprenorphine-O3-glucuronide
Systematic (IUPAC) name
N/A
Identifiers
CAS number  ?
ATC code  ?
PubChem 6426800
Chemical data
Formula C35H49NO10
Mol. mass 643.76426
SMILES eMolecules & PubChem
Pharmacokinetic data
Bioavailability  ?
Metabolism  ?
Half life  ?
Excretion  ?
Therapeutic considerations
Pregnancy cat.

?

Legal status
Routes  ?

[edit] Description

[edit] General Properties

*Molecular Weight

643.76426

*Molecular Formula

C35H49NO10

*IUPAC NAME

N/A

*Canonical Smiles

CC(C)(C)C(C)(C1CC23CCC1(C4C25CCN(C3CC6=C5C(=C(C=C6)OC7C(C(C(C(O7)C(=O)O)O)O)O)O4)CC8CC8)OC)O

*Isomeric Smiles

CC(C)(C)[C@](C)([C@H]1C[C@@]23CCC1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)OC7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O)O)O)O4)CC8CC8)OC)O

*XLogP

2.5

*Topological Polar Surface Area

158

[edit] External Links

Link to BIAdb Database