1-[(1R)-1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-heptoxypropan-2-ol;dihydrochloride
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1-[(1R)-1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-heptoxypropan-2-ol;dihydrochloride
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CAS No:
26988-04-5
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Formula:
C39H62Cl2N2O6
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Chemical Name:
1-[(1R)-1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-heptoxypropan-2-ol;dihydrochloride
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Synonyms:
26988-04-5;DTXSID40949767;Emetine, 2'-(3-(heptyloxy)-2-hydroxypropyl)-, dihydrochloride;Emetine, 2'-(3-(heptyloxy)-2-hydroxypropyl)-, dihydrochloride (8CI);2-Propanol, 1-(heptyloxy)-3-(6',7',10,11-tetramethoxyemetan-2'-yl)-, dihydrochloride;2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-(3-heptyloxy-2-hydroxypropyl)-1-isoquinolyl)methyl)-, dihydrochloride, isopropanol;1-(Heptyloxy)-3-(6',7',10,11-tetramethoxyemetan-2'-yl)propan-2-ol--hydrogen chloride (1/2)
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CAS No:
1-[(1R)-1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-heptoxypropan-2-ol;dihydrochloride Basic Attributes
725.8 g/mol
724.3984931 g/mol
Computed Properties
Molecular Weight:725.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:17
Exact Mass:724.3984931
Monoisotopic Mass:724.3984931
Topological Polar Surface Area:72.9
Heavy Atom Count:49
Complexity:896
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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