Dehydroisoemetine, (+/-)-

(11bS)-2-[[(1S)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-3-ethyl-9,10-dimethoxy-4,6,7,11b-tetrahydro-1H-benzo[a]quinolizine

Also Known As: Dehydroisoemetine|2-Dehydroisoemetine|(Iso)-Dehydroemetine|Dehydroisoemetine, (+/-)-|2,3-Didehydroisoemetin|2,3-Didehydroisoemetine|Isoemetine, 2-dehydro-|(+/-)-2,3-Didehydroisoemetine|Emetan, 2,3-didehydro-6',7',10,11-tetramethoxy-, (1'beta)-(+/-)-|4H-Benzo(a)quinolizine, 3-ethyl-1,6,7,11b-tetrahydro-9,10-dimethoxy-2-(((1R)-1,2,3,4-tetrahydro-6,7-dimethoxy-1-isoquinolinyl)methyl)-, (11bR)-rel-|6',7',10,11-Tetramethoxy-1'beta-2,3-didehydroemetan|Emetan, 2',3'-didehydro-6',7',10,11-tetramethoxy-|Emetan, 2,3-didehydro-6',7',10,11-tetramethoxy-, (1'beta)-|(1 S,14S)-2,3-Didehydro-6 ,7 ,10,11-tetramethoxyemetan|EMETAN, 2,3-DIDEHYDRO-6',7',10,11-TETRAMETHOXY-, (1'.BETA.)-|EMETAN, 2,3-DIDEHYDRO-6',7',10,11-TETRAMETHOXY-, (1'.BETA.)-(+/-)-|(1S)-1-{[(11bS)-3-ethyl-9,10-dimethoxy-1H,4H,6H,7H,11bH-pyrido[2,1-a]isoquinolin-2-yl]methyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Molecular Formula	C29H38N2O4
Molecular Weight	478.28317 g/mol
LogP	5.0076
Topological Polar Surface Area	52.19 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	478.28317
Monoisotopic Mass	478.28317
Heavy Atoms	35
Complexity	1126.1503

Chemical Identifiers

CAS Number	66899-87-4
SMILES	CCC1=C(C[C@H]2C3=CC(=C(C=C3CCN2C1)OC)OC)C[C@H]4C5=CC(=C(C=C5CCN4)OC)OC