BIAdb Buprenorphine 1647

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Revision as of 00:00, 15 January 2001

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BIAdb Buprenorphine 1647
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	441363
Chemical data
Formula	C29H41NO4
Mol. mass	467.64014
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

Contents 1 Description 2 Source 3 Function 4 General Properties 5 External Links

Description

Source

N/A

Function

Analgesic

General Properties

*Molecular Weight

467.64014

*Exact Mass

467.303559

*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

CC(C)(C)C(C)([C@H]1C[C@@]23CCC1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)CC7CC7)OC)O

*XLogP

5

*Hydrogen bond donor

2

*Hydrogen bond acceptor

5

*Rotational Bond Count

5

*Topological Polar Surface Area

62.2

External Links

• Pubchem

• KEGG

Link to BIAdb Database