Thebaine

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Thebaine
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	408120
Chemical data
Formula	C19H21NO3
Mol. mass	311.37494
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

Description

A drug that is derived from opium, which contains from 0.3-1.5% thebaine depending on its origin. It produces strychnine-like convulsions rather than narcosis. It may be habit-forming and is a controlled substance (opiate) listed in the U.S. Code of Federal Regulations, Title 21 Part 1308.12 (1985). (From Merck Index, 11th ed)

General Properties

*Molecular Weight

311.37494

*Molecular Formula

C₁₉H₂₁NO₃

*IUPAC NAME

N/A

*Canonical Smiles

CN1CCC23C4C(=CC=C2C1CC5=C3C(=C(C=C5)OC)O4)OC

*Isomeric Smiles

N/A

*XLogP

1.9

*Topological Polar Surface Area

30.9

External Links

• Pubchem

Link to BIAdb Database