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Home > Encyclopedia > 1′-O-Acetylpaxilline

1′-O-Acetylpaxilline

1′-O-Acetylpaxilline structure

1′-O-Acetylpaxilline 

structure
  • CAS No:

    121998-08-1

  • Formula:

    C29H35NO5

  • Chemical Name:

    1′-O-Acetylpaxilline

  • Synonyms:

    2H-1-Benzopyrano[5′,6′:6,7]indeno[1,2-b]indol-3(4bH)-one,2-[1-(acetyloxy)-1-methylethyl]-5,6,6a,7,12,12b,12c,13,14,14a-decahydro-4b-hydroxy-12b,12c-dimethyl-,(2R,4bS,6aS,12bS,12cR,14aS)-;2H-1-Benzopyrano[5′,6′:6,7]indeno[1,2-b]indol-3(4bH)-one,2-[1-(acetyloxy)-1-methylethyl]-5,6,6a,7,12,12b,12c,13,14,14a-decahydro-4b-hydroxy-12b,12c-dimethyl-,[2R-(2α,4bβ,6aα,12bβ,12cα,14aβ)]-;(2R,4bS,6aS,12bS,12cR,14aS)-2-[1-(Acetyloxy)-1-methylethyl]-5,6,6a,7,12,12b,12c,13,14,14a-decahydro-4b-hydroxy-12b,12c-dimethyl-2H-1-benzopyrano[5′,6′:6,7]indeno[1,2-b]indol-3(4bH)-one;1′-O-Acetylpaxilline

1′-O-Acetylpaxilline Basic Attributes

477.59200

477.59

P2WL8YH7EG

Characteristics

88.62000

4.52750

1.29g/cm3

653.8ºC

349.2ºC

1.634

5.54E-18mmHg at 25°C

Drug Information

1'-O-acetylpaxilline

Computed Properties

Molecular Weight:477.6
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:477.25152322
Monoisotopic Mass:477.25152322
Topological Polar Surface Area:88.6
Heavy Atom Count:35
Complexity:974
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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