Nudicauline
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Nudicauline
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CAS No:
99815-83-5
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Formula:
C38H50N2O11
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Chemical Name:
Nudicauline
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Synonyms:
Aconitane-7,8,14-triol,20-ethyl-1,6,16-trimethoxy-4-[[[2-[(3S)-3-methyl-2,5-dioxo-1-pyrrolidinyl]benzoyl]oxy]methyl]-,14-acetate,(1α,6β,14α,16β)-;Aconitane-7,8,14-triol,20-ethyl-1,6,16-trimethoxy-4-[[[2-(3-methyl-2,5-dioxo-1-pyrrolidinyl)benzoyl]oxy]methyl]-,14-acetate,[1α,4(S),6β,14α,16β]-;Nudicauline;O14-Demethylmethyllycaconitine 14-acetate;Andersoline;Nudikauline
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CAS No:
Computed Properties
Molecular Weight:710.8
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:11
Exact Mass:710.34146042
Monoisotopic Mass:710.34146042
Topological Polar Surface Area:161
Heavy Atom Count:51
Complexity:1480
Defined Atom Stereocenter Count:11
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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