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Home > Encyclopedia > 3-Pyridinecarboxylic acid, 4,6-bis(acetyloxy)-10-[(3-furanylcarbonyl)oxy]octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester

3-Pyridinecarboxylic acid, 4,6-bis(acetyloxy)-10-[(3-furanylcarbonyl)oxy]octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester

3-Pyridinecarboxylic acid, 4,6-bis(acetyloxy)-10-[(3-furanylcarbonyl)oxy]octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester structure

3-Pyridinecarboxylic acid, 4,6-bis(acetyloxy)-10-[(3-furanylcarbonyl)oxy]octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 

structure
  • CAS No:

    52658-32-9

  • Formula:

    C30H35NO10

  • Chemical Name:

    3-Pyridinecarboxylic acid, 4,6-bis(acetyloxy)-10-[(3-furanylcarbonyl)oxy]octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester

  • Synonyms:

    3-Pyridinecarboxylic acid,4,6-bis(acetyloxy)-10-[(3-furanylcarbonyl)oxy]octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester;2H-3,9a-Methano-1-benzoxepin,3-pyridinecarboxylic acid deriv.;Celapanine;Celapanin;58165-89-2

Description

Celapanine is a sesquiterpenoid.

3-Pyridinecarboxylic acid, 4,6-bis(acetyloxy)-10-[(3-furanylcarbonyl)oxy]octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester Basic Attributes

569.6

569.60

DTXSID30331859

Characteristics

141

Computed Properties

Molecular Weight:569.6
XLogP3:3.5
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:569.22609631
Monoisotopic Mass:569.22609631
Topological Polar Surface Area:141
Heavy Atom Count:41
Complexity:1060
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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