O-methylthalibrine
(1S)-1-[[4-[5-[[(1S)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline
Also Known As: O-methylthalibrine|O-Methyldauricine|Thalibrine methyl ether|(+)-O-Methylthalibrine|KST-1A7246|J2.428.803J|(1s)-1-[4-(5-{[(1s)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-2-methoxyphenoxy)benzyl]-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline|(1S)-1-[[4-[5-[[(1S)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline|Isoquinoline,1,2,3,4-tetrahydro-6,7-dimethoxy-1-[[4-[2-methoxy-5-[(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl]phenoxy]phenyl]methyl]-2-methyl-,[S-(R*,R*)]- (9CI)|(1S)-1,2,3,4-Tetrahydro-6,7-dimethoxy-1-[4-[2-methoxy-5-[[(1S)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methylisoquinoline-1-yl]methyl]phenoxy]benzyl]-2-methylisoquinoline|(1S)-1,2,3,4-Tetrahydro-6,7-dimethoxy-2-methyl-1-[4-methoxy-3-[4-[[[(1S)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methylisoquinoline]-1-yl]methyl]phenoxy]benzyl]isoquinoline|(1S)-1-{[3-(4-{[(1S)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}phenoxy)-4-methoxyphenyl]methyl}-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline|(1S)-1-{[4-(5-{[(1S)-6,7-DIMETHOXY-2-METHYL-1,2,3,4-TETRAHYDROISOQUINOLIN-1-YL]METHYL}-2-METHOXYPHENOXY)PHENYL]METHYL}-6,7-DIMETHOXY-2-METHYL-1,2,3,4-TETRAHYDROISOQUINOLINE|1-[(4-{5-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-2-methoxyphenoxy}phenyl)methyl]-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline|1-Methoxy-2-[4-[[(1S)-2-methyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-1alpha-yl]methyl]phenoxy]-4-[[(1S)-2-methyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-1alpha-yl]methyl]benzene
| Molecular Formula | C39H46N2O6 |
|---|---|
| Molecular Weight | 638.3356 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 61.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 638.3356 |
| Monoisotopic Mass | 638.3356 |
| Heavy Atoms | 47 |
| Complexity | 948.0 |
Chemical Identifiers
| CAS Number | 6629-22-7 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C=C2[C@@H]1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)C[C@H]5C6=CC(=C(C=C6CCN5C)OC)OC)OC)OC)OC |
| InChIKey | UHYCXSGUNAWVBW-LQJZCPKCSA-N |
Product Overview
O-methylthalibrine (CAS 6629-22-7), with molecular formula C39H46N2O6 and molecular weight 638.3356 g/mol. IUPAC: (1S)-1-[[4-[5-[[(1S)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline.
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