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Deacetylnomilin

Deacetylnomilin structure

Deacetylnomilin 

structure
  • CAS No:

    3264-90-2

  • Formula:

    C26H32O8

  • Chemical Name:

    Deacetylnomilin

  • Synonyms:

    Oxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione,1-(3-furanyl)decahydro-11-hydroxy-4b,7,7,11a,13a-pentamethyl-,(1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-;Obacunoic acid,1,2-dihydro-1-hydroxy-,ε-lactone,(1S)-;Nomilin,deacetyl-;(1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-1-(3-Furanyl)decahydro-11-hydroxy-4b,7,7,11a,13a-pentamethyloxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione;Deacetylnomilin;Deacetylnomilinate

Description

Deacetylnomilin is a limonoid.

Deacetylnomilin Basic Attributes

472.534

472.53

Characteristics

116

2

1.35±0.1 g/cm3(Predicted)

253-255 °C (decomp)

Computed Properties

Molecular Weight:472.5
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:1
Exact Mass:472.20971797
Monoisotopic Mass:472.20971797
Topological Polar Surface Area:116
Heavy Atom Count:34
Complexity:976
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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