Aconitane-4-methanol, 20-ethyl-7-hydroxy-1,6,8,14,16-pentamethoxy-, α-[2-[(4-methoxy-1,4-dioxobutyl)amino]benzoate], (1α,6β,14α,16β)-
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![Aconitane-4-methanol, 20-ethyl-7-hydroxy-1,6,8,14,16-pentamethoxy-, α-[2-[(4-methoxy-1,4-dioxobutyl)amino]benzoate], (1α,6β,14α,16β)- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/98593ecd74c1456d8bd413254134aedc.png "Aconitane-4-methanol, 20-ethyl-7-hydroxy-1,6,8,14,16-pentamethoxy-, α-[2-[(4-methoxy-1,4-dioxobutyl)amino]benzoate], (1α,6β,14α,16β)-")
Aconitane-4-methanol, 20-ethyl-7-hydroxy-1,6,8,14,16-pentamethoxy-, α-[2-[(4-methoxy-1,4-dioxobutyl)amino]benzoate], (1α,6β,14α,16β)-
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CAS No:
70553-63-8
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Formula:
C38H54N2O11
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Chemical Name:
Aconitane-4-methanol, 20-ethyl-7-hydroxy-1,6,8,14,16-pentamethoxy-, α-[2-[(4-methoxy-1,4-dioxobutyl)amino]benzoate], (1α,6β,14α,16β)-
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Synonyms:
Aconitane-4-methanol,20-ethyl-7-hydroxy-1,6,8,14,16-pentamethoxy-,α-[2-[(4-methoxy-1,4-dioxobutyl)amino]benzoate],(1α,6β,14α,16β)-;2H-12,3,6a-Ethanylylidene-7,9-methanonaphth[2,3-b]azocine,aconitane-4-methanol deriv.;Septentrionine
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CAS No:
Aconitane-4-methanol, 20-ethyl-7-hydroxy-1,6,8,14,16-pentamethoxy-, α-[2-[(4-methoxy-1,4-dioxobutyl)amino]benzoate], (1α,6β,14α,16β)- Basic Attributes
714.8 g/mol
714.84
DTXSID60331620
Computed Properties
Molecular Weight:714.8
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:15
Exact Mass:714.37276054
Monoisotopic Mass:714.37276054
Topological Polar Surface Area:151
Heavy Atom Count:51
Complexity:1350
Defined Atom Stereocenter Count:12
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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