Chem
J-GLOBAL ID：200907056169264487   Nikkaji number：J16.122E

Bakkenolide A

バッケノリド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： C15H22O2
Molecular formula furigana： C15-H22-O2
Molecular weight： 234.339
InChI： InChI=1S/C15H22O2/c1-10-5-4-6-12-7-15(9-14(10,12)3)11(2)8-17-13(15)16/h10,12H,2,4-9H2,1,3H3/t10-,12+,14+,15+/m0/s1
InChI key： OVXAYHNZXBOVPV-QMGNLALYSA-N
SMILES： C[C@H]1CCC[C@@H]2C[C@@]3(C[C@]12C)C(=C)COC3=O
Systematic name  (5)：
  • (2R)-1,3,3a,4,4′,5,5′,6,7,7aβ-デカヒドロ-3aβ,4β-ジメチル-4′-メチレンスピロ[2H-インデン-2,3′(2′H)-フラン]-2′-オン
  • (3R)-1′,3′,3′a,4,4′,5,5′,6′,7′,7′aβ-デカヒドロ-3′aβ,4′β-ジメチル-4-メチレンスピロ[フラン-3(2H),2′-[2H]インデン]-2-オン
  • (3R,3′aR,7′aβ)-3′aβ,4′β-ジメチル-4-メチレンスピロ[オキソラン-3,2′-ヒドリンダン]-2-オン
  • (2R,3aR,4S,7aR)-3a,4-ジメチル-4'-メチリデン-オクタヒドロスピロ[インデン-2,3'-オキソラン]-2'-オン
  • (2R,3aR,4S,7aR)-3a,4-dimethyl-4'-methylidene-octahydrospiro[indene-2,3'-oxolan]-2'-one
Other name (8)：
  • フキナノリド
  • バッケノリドA
  • Fukinanolide
  • Bakkenolide A
  • (3R)-1′,3′,3′a,4,4′,5,5′,6′,7′,7′aβ-Decahydro-3′aβ,4′β-dimethyl-4-methylenespiro[furan-3(2H),2′-[2H]inden]-2-one
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CAS registry number： 19906-72-0
KEGG COMPOUND： C09350
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