Isothebaine hydrochloride

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Isothebaine hydrochloride
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	?

*Molecular Weight

347.83588

*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

*Topological Polar Surface Area

43.1

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	[http://crdd.osdd.net/raghava/biadb/detail.php?id=1511 Link to BIAdb Database]		[http://crdd.osdd.net/raghava/biadb/detail.php?id=1511 Link to BIAdb Database]
		+	[[Category:BIAdb_old]]