1S,9R-beta-HYDRASTINE

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1S,9R-beta-HYDRASTINE
Systematic (IUPAC) name
(3R)-6,7-dimethoxy-3-[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]-3H-2-benzofuran-1-one
Identifiers
CAS number	?
ATC code	?
PubChem	5702143
Chemical data
Formula	C₂₀H₂₁NO₄
Mol. mass	339.38504
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

*Molecular Weight

339.38504

*Molecular Formula

C₂₀H₂₁NO₄

*IUPAC NAME

(3R)-6,7-dimethoxy-3-[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]-3H-2-benzofuran-1-one

*Canonical Smiles

CN1CCC2=CC=CC=C2C1C3C4=C(C(=C(C=C4)OC)OC)C(=O)O3

*Isomeric Smiles

CN1CCC2=CC=CC=C2[C@H]1[C@H]3C4=C(C(=C(C=C4)OC)OC)C(=O)O3

*XLogP

2.8

*Topological Polar Surface Area

48