 Home > Encyclopedia > 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]butan-2-ol;dihydrochloride

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]butan-2-ol;dihydrochloride

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]butan-2-ol;dihydrochloride structure

CAS No:
26987-94-0
Formula:
C33H50Cl2N2O5
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]butan-2-ol;dihydrochloride
Synonyms:
26987-94-0;2'-(2-Hydroxybutyl)emetine dihydrochloride;2'-(2-Hydroxybutyl)emetine HCl;DTXSID50949758;2-Butanol, 1-(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-(2-hydroxybutyl)-1-isoquinolyl)methyl)-, dihydrochloride;Emetine, 2'-(2-hydroxybutyl)-, dihydrochloride (8CI);1-(6',7',10,11-Tetramethoxyemetan-2'-yl)butan-2-ol--hydrogen chloride (1/2)

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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]butan-2-ol;dihydrochloride Basic Attributes

Molecular Weight：

625.7 g/mol

Exact Mass：

624.3096781 g/mol

Characteristics

PSA：

63.6 Å²

Computed Properties

Molecular Weight:625.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:624.3096781
Monoisotopic Mass:624.3096781
Topological Polar Surface Area:63.6
Heavy Atom Count:42
Complexity:786
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

Hot Searches: phenacetin drug; methyl ethyl ketoxime; 1-pentanol; janoshik; gluconic acid; difenidol

Guide of 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]butan-2-ol;dihydrochloride

Basic Attributes
Characteristics
Computed Properties

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