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Clausmarin A

Clausmarin A structure

Clausmarin A 

structure
  • CAS No:

    67604-65-3

  • Formula:

    C24H30O5

  • Chemical Name:

    Clausmarin A

  • Synonyms:

    Clausmarin; 8H-Dipyrano(3,2-b:3',2'-g)(1)benzopyran-8-one,2,3,4,4a,12,12a-hexahydro-9-(1,1-dimethyl-2-propenyl)-2-(1-hydroxy-1-methylethyl)-4a-methyl; 8H-Dipyrano(3,2-b:3',2'-g)(1)benzopyran-8-one,9-(1,1-dimethyl-2-propenyl)-2,3,4,4a,12,12a-hexahydro-2-(1-hydroxy-1-methylethyl)-4a-methyl;

Clausmarin A Basic Attributes

398.49200

398.20932405 g/mol

380683

Characteristics

68.90000

4.26870

1.186g/cm3

542.8ºC at 760 mmHg

182.6ºC

1.564

Drug Information

clausmarin

Computed Properties

Molecular Weight:398.5
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:398.20932405
Monoisotopic Mass:398.20932405
Topological Polar Surface Area:65
Heavy Atom Count:29
Complexity:723
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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