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Home > Encyclopedia > nemadectin β

nemadectin β

nemadectin β structure

nemadectin β 

structure
  • CAS No:

    102042-08-0

  • Formula:

    C34H48O8

  • Chemical Name:

    nemadectin β

  • Synonyms:

    Milbemycin B,5-O-demethyl-28-deoxy-6,28-epoxy-23-hydroxy-25-(1-methyl-1-propenyl)-,(6S,23S,25S(E));

  • Categories:

    Organic Chemistry  >  Lactones

nemadectin β Basic Attributes

584.74000

584.33491849

Characteristics

114.68000

4.45130

1.23g/cm3

780.1ºC at 760mmHg

245.2ºC

1.586

4.15E-28mmHg at 25°C

Drug Information

F 28249alpha

Computed Properties

Molecular Weight:584.7
XLogP3:3.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:1
Exact Mass:584.33491849
Monoisotopic Mass:584.33491849
Topological Polar Surface Area:115
Heavy Atom Count:42
Complexity:1200
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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