Chem
J-GLOBAL ID:200907004043926204   Nikkaji number:J1.343.008J

Plakortone A

プラコルトンA
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C22H36O3
Molecular formula furigana: C22-H36-O3
Molecular weight: 348.527
InChI: InChI=1S/C22H36O3/c1-6-11-12-17(7-2)13-18(8-3)15-21(9-4)16-22(10-5)19(24-21)14-20(23)25-22/h11-12,15,17,19H,6-10,13-14,16H2,1-5H3/b12-11+,18-15+/t17?,19-,21-,22-/m1/s1
InChI key: MRLHJEHWGDONOP-FMEMCTMMSA-N
SMILES: CC/C=C/C(CC)C/C(=C/[C@]1(CC)C[C@@]2(CC)OC(=O)C[C@H]2O1)/CC
Systematic name  (3):
  • (3aR)-5β,6aα-ジエチル-5-[(1E,5E)-2,4-ジエチル-1,5-オクタジエニル]-3aα,5,6,6a-テトラヒドロフロ[3,2-b]フラン-2(3H)-オン
  • (3aR,5S,6aR)-5-[(1E,5E)-2,4-ジエチルオクタ-1,5-ジエン-1-イル]-5,6a-ジエチル-ヘキサヒドロフロ[3,2-b]フラン-2-オン
  • (3aR,5S,6aR)-5-[(1E,5E)-2,4-diethylocta-1,5-dien-1-yl]-5,6a-diethyl-hexahydrofuro[3,2-b]furan-2-one
Other name (3):
  • (3aR)-5β,6aα-Diethyl-5-[(1E,5E)-2,4-diethyl-1,5-octadienyl]-3aα,5,6,6a-tetrahydrofuro[3,2-b]furan-2(3H)-one
  • プラコルトンA
  • Plakortone A
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