Reticuline N-oxide

Reticuline N-oxide
Systematic (IUPAC) name
(1S)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-7-ol
Identifiers
CAS number	?
ATC code	?
PubChem	13020032
Chemical data
Formula	C₁₉H₂₃NO₅
Mol. mass	345.38962
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

*Molecular Weight

345.38962

*Molecular Formula

C₁₉H₂₃NO₅

*IUPAC NAME

(1S)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-7-ol

*Canonical Smiles

C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)O)O)OC)[O-]

*Isomeric Smiles

C[N+]1(CCC2=CC(=C(C=C2[C@@H]1CC3=CC(=C(C=C3)OC)O)O)OC)[O-]

*XLogP

1.5

*Topological Polar Surface Area

82