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Beiwutine

Beiwutine structure

Beiwutine 

structure
  • CAS No:

    76918-93-9

  • Formula:

    C33H45NO12

  • Chemical Name:

    Beiwutine

  • Synonyms:

    Aconitane-3,8,10,13,14,15-hexol,1,6,16-trimethoxy-4-(methoxymethyl)-20-methyl-,8-acetate 14-benzoate,(1α,3α,6α,14α,15α,16β)-;2H-12,3,6a-Ethanylylidene-7,9-methanonaphth[2,3-b]azocine,aconitane-3,8,10,13,14,15-hexol deriv.;Beiwutine;10-Hydroxymesaconitine;1146978-81-5

  • Categories:

    Biochemical Engineering  >  Chinese Herbs

Description

Beiwutine is a benzoate ester.

Beiwutine Basic Attributes

647.714

647.71

Characteristics

1.44±0.1 g/cm3(Predicted)

Computed Properties

Molecular Weight:647.7
XLogP3:-1.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:10
Exact Mass:647.29417587
Monoisotopic Mass:647.29417587
Topological Polar Surface Area:174
Heavy Atom Count:46
Complexity:1250
Defined Atom Stereocenter Count:14
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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    CAS No.: 76918-93-9
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    Content: 99%
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