Chem
J-GLOBAL ID:200907049648725891   Nikkaji number:J1.126.156F

(3S)-6-(3-Oxobutyl)-3,3a,8,8a-tetrahydro-3β,7-dimethyl-2H-cyclohepta[b]furan-2,5(4H)-dione

4,5-ジオキソキサント-1(10)-エン-13α-メチル-12,8β-オリド
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: C15H20O4
Molecular formula furigana: C15-H20-O4
Molecular weight: 264.321
InChI: InChI=1S/C15H20O4/c1-8-6-14-12(10(3)15(18)19-14)7-13(17)11(8)5-4-9(2)16/h10,12,14H,4-7H2,1-3H3/t10-,12?,14?/m0/s1
InChI key: UUKUKOWRPZPCIE-JKDOVBDQSA-N
SMILES: C[C@H]1C2CC(=O)C(=C(C)CC2OC1=O)CCC(=O)C
Systematic name  (3):
  • (3S)-6-(3-オキソブチル)-3,3a,8,8a-テトラヒドロ-3β,7-ジメチル-2H-シクロヘプタ[b]フラン-2,5(4H)-ジオン
  • (3S)-3,7-ジメチル-6-(3-オキソブチル)-2H,3H,3aH,4H,5H,8H,8aH-シクロヘプタ[b]フラン-2,5-ジオン
  • (3S)-3,7-dimethyl-6-(3-oxobutyl)-2H,3H,3aH,4H,5H,8H,8aH-cyclohepta[b]furan-2,5-dione
Other name (2):
  • (3S)-6-(3-Oxobutyl)-3,3a,8,8a-tetrahydro-3β,7-dimethyl-2H-cyclohepta[b]furan-2,5(4H)-dione
  • 4,5-ジオキソキサント-1(10)-エン-13α-メチル-12,8β-オリド
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