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Home > Encyclopedia > (1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-Hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione

(1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-Hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione

(1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-Hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione structure

(1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-Hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione 

structure
  • CAS No:

    17617-46-8

  • Formula:

    C15H18O6

  • Chemical Name:

    (1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-Hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione

  • Synonyms:

    3,6-Methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione,hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-,(1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-;Picrotoxinin,α-dihydro-;3,6-Methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione,hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-,[1aR-(1aα,2aβ,3β,6β,6aβ,8aS*,8bβ,9S*)]-;(1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-Hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione;Dihydropicrotoxinin;α-Dihydropicrotoxinin;60565-08-4

(1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-Hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione Basic Attributes

294.30 g/mol

294.30

Characteristics

85.4 Ų

Drug Information

alpha-dihydropicrotoxinin

Computed Properties

Molecular Weight:294.30
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:294.11033829
Monoisotopic Mass:294.11033829
Topological Polar Surface Area:85.4
Heavy Atom Count:21
Complexity:601
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of (1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-Hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethyl)-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione

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