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Home > Encyclopedia > (3aR,6Z,9R,10aS,11aS)-2,3,3a,10,10a,11a-Hexahydro-3,3,6,9,11a-pentamethyl-1H-dicyclopenta[a,d]cyclononene-1,5,11(4H,9H)-trione

(3aR,6Z,9R,10aS,11aS)-2,3,3a,10,10a,11a-Hexahydro-3,3,6,9,11a-pentamethyl-1H-dicyclopenta[a,d]cyclononene-1,5,11(4H,9H)-trione

(3aR,6Z,9R,10aS,11aS)-2,3,3a,10,10a,11a-Hexahydro-3,3,6,9,11a-pentamethyl-1H-dicyclopenta[a,d]cyclononene-1,5,11(4H,9H)-trione structure

(3aR,6Z,9R,10aS,11aS)-2,3,3a,10,10a,11a-Hexahydro-3,3,6,9,11a-pentamethyl-1H-dicyclopenta[a,d]cyclononene-1,5,11(4H,9H)-trione 

structure
  • CAS No:

    58298-76-3

  • Formula:

    C20H26O3

  • Chemical Name:

    (3aR,6Z,9R,10aS,11aS)-2,3,3a,10,10a,11a-Hexahydro-3,3,6,9,11a-pentamethyl-1H-dicyclopenta[a,d]cyclononene-1,5,11(4H,9H)-trione

  • Synonyms:

    1H-Dicyclopenta[a,d]cyclononene-1,5,11(4H,9H)-trione,2,3,3a,10,10a,11a-hexahydro-3,3,6,9,11a-pentamethyl-,(3aR,6Z,9R,10aS,11aS)-;1H-Dicyclopenta[a,d]cyclononene-1,5,11(4H,9H)-trione,2,3,3a,10,10a,11a-hexahydro-3,3,6,9,11a-pentamethyl-,[3aR-(3aR*,6Z,9R*,10aS*,11aS*)]-;(3aR,6Z,9R,10aS,11aS)-2,3,3a,10,10a,11a-Hexahydro-3,3,6,9,11a-pentamethyl-1H-dicyclopenta[a,d]cyclononene-1,5,11(4H,9H)-trione;Jatrophatrione;NSC 254668

Description

Jatrophatrione is a diterpenoid.

(3aR,6Z,9R,10aS,11aS)-2,3,3a,10,10a,11a-Hexahydro-3,3,6,9,11a-pentamethyl-1H-dicyclopenta[a,d]cyclononene-1,5,11(4H,9H)-trione Basic Attributes

314.425

314.42

Characteristics

51.2

3

1.13 g/cm3

Drug Information

jatrophatrione

Computed Properties

Molecular Weight:314.4
XLogP3:3
Hydrogen Bond Acceptor Count:3
Exact Mass:314.18819469
Monoisotopic Mass:314.18819469
Topological Polar Surface Area:51.2
Heavy Atom Count:23
Complexity:664
Defined Atom Stereocenter Count:4
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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