Chem
J-GLOBAL ID：200907022050934008   Nikkaji number：J20.676H

Eupatolide

オイパトリド
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： C15H20O3
Molecular formula furigana： C15-H20-O3
Molecular weight： 248.322
InChI： InChI=1S/C15H20O3/c1-9-5-4-6-10(2)8-13-14(12(16)7-9)11(3)15(17)18-13/h5,8,12-14,16H,3-4,6-7H2,1-2H3/b9-5+,10-8+/t12-,13-,14-/m1/s1
InChI key： PDEJECFRCJOMEN-OURLZOILSA-N
SMILES： C/C/1=C\CC/C(=C/[C@H]2OC(=O)C(=C)[C@@H]2[C@H](O)C1)/C
Systematic name  (3)：
  • (3aR,4R,6E,10E,11aR)-3a,4,5,8,9,11a-ヘキサヒドロ-4-ヒドロキシ-6,10-ジメチル-3-メチレンシクロデカ[b]フラン-2(3H)-オン
  • (3aR,4R,11aR)-4-ヒドロキシ-6,10-ジメチル-3-メチリデン-2H,3H,3aH,4H,5H,8H,9H,11aH-シクロデカ[b]フラン-2-オン
  • (3aR,4R,11aR)-4-hydroxy-6,10-dimethyl-3-methylidene-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-2-one
Other name (3)：
  • オイパトリド
  • Eupatolide
  • (3aR,4R,6E,10E,11aR)-3a,4,5,8,9,11a-Hexahydro-4-hydroxy-6,10-dimethyl-3-methylenecyclodeca[b]furan-2(3H)-one
CAS registry number： 6750-25-0
KEGG COMPOUND： C09440
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