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-piperidin-1-ylpropan-2-ol;trihydrochloride
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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-piperidin-1-ylpropan-2-ol;trihydrochloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ea304bb5a47b431c9d0fd41eb300717f.png "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-piperidin-1-ylpropan-2-ol;trihydrochloride")
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-piperidin-1-ylpropan-2-ol;trihydrochloride
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CAS No:
26988-00-1
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Formula:
C37H58Cl3N3O5
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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-piperidin-1-ylpropan-2-ol;trihydrochloride
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Synonyms:
26988-00-1;DTXSID60949764;Emetine, 2'-(2-hydroxy-3-piperidinopropyl)-, trihydrochloride (8CI);2-Propanol, 1-(1-piperidinyl)-3-(6',7',10,11-tetramethoxyemetan-2'-yl)-, trihydrochloride;2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-(2-hydroxy-3-piperidinopropyl)-1-isoquinolyl)methyl)-, trihydrochloride, hemiisopropanol;2'-(2-Hydroxy-3-piperidinopropyl)emetine tri-HCl;1-(Piperidin-1-yl)-3-(6',7',10,11-tetramethoxyemetan-2'-yl)propan-2-ol--hydrogen chloride (1/3)
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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-piperidin-1-ylpropan-2-ol;trihydrochloride Basic Attributes
731.2 g/mol
729.344205 g/mol
Computed Properties
Molecular Weight:731.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:11
Exact Mass:729.344205
Monoisotopic Mass:729.344205
Topological Polar Surface Area:66.9
Heavy Atom Count:48
Complexity:905
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes
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