BIAdb Isothebaine hydrochloride 2467

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BIAdb Isothebaine hydrochloride 2467
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	33131
Chemical data
Formula	C19H22ClNO3
Mol. mass	347.83588
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

Unknown

General Properties

*Molecular Weight

347.83588

*Exact Mass

347.128821

*Molecular Formula

C₁₉H₂₂ClNO₃

*IUPAC NAME

N/A

*Canonical Smiles

C[NH+]1CCC2=CC(=C(C3=C2C1CC4=C3C(=CC=C4)OC)O)OC.[Cl-]

*Isomeric Smiles

C[NH+]1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=CC=C4)OC)O)OC.[Cl-]

*XLogP

N/A

*Hydrogen bond donor

2

*Hydrogen bond acceptor

4

*Rotational Bond Count

2

*Topological Polar Surface Area

43.1

External Links

• Pubchem

Link to BIAdb Database