8-acetyl-14-benzoylchasmanine
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8-acetyl-14-benzoylchasmanine
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CAS No:
4296-54-2
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Formula:
C34H47NO8
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Chemical Name:
8-acetyl-14-benzoylchasmanine
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Synonyms:
8-acetyl-14-benzoylchasmanine;13,15-Dideoxyaconitine;DTXSID70962808;8-(Acetyloxy)-20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl benzoate;77757-14-3;Aconitane-3,8,14-triol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 8-acetate 14-benzoate, (1alpha,3alpha,6alpha,14alpha,16beta)-;Aconitane-8,14-diol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 8-acetate 14-benzoate, (1alpha,6alpha,14alpha,16beta)-
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CAS No:
Computed Properties
Molecular Weight:597.7
XLogP3:3.3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:11
Exact Mass:597.33016746
Monoisotopic Mass:597.33016746
Topological Polar Surface Area:92.8
Heavy Atom Count:43
Complexity:1100
Undefined Atom Stereocenter Count:13
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes