Chem
J-GLOBAL ID：200907001461049822   Nikkaji number：J414.417A

(1R,2S,3E,7E,11E)-Cembra-3,7,11,15-tetraen-17,2-olide

(1R,2S,3E,7E,11E)センブラ-3,7,11,15-テトラエン-17,2-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： C20H28O2
Molecular formula furigana： C20-H28-O2
Molecular weight： 300.442
InChI： InChI=1S/C20H28O2/c1-14-7-5-9-15(2)11-12-18-17(4)20(21)22-19(18)13-16(3)10-6-8-14/h8-9,13,18-19H,4-7,10-12H2,1-3H3/b14-8+,15-9+,16-13+/t18-,19+/m1/s1
InChI key： RCAHBKAGTYTMES-ZEMHAMIXSA-N
SMILES： C/C/1=C\CC/C(=C/[C@@H]2OC(=O)C(=C)[C@H]2CC/C(=C/CC1)/C)/C
Systematic name  (4)：
  • (3aR,6E,10E,14E)-3-メチレン-6,10,14-トリメチル-3aα,4,5,8,9,12,13,15aβ-オクタヒドロシクロテトラデカ[b]フラン-2(3H)-オン
  • (1S,2E,6E,10E,14R)-15-メチレン-3,7,11-トリメチル-17-オキサビシクロ[12.3.0]ヘプタデカン-2,6,10-トリエン-16-オン
  • (3aR,15aS)-6,10,14-トリメチル-3-メチリデン-2H,3H,3aH,4H,5H,8H,9H,12H,13H,15aH-シクロテトラデカ[b]フラン-2-オン
  • (3aR,15aS)-6,10,14-trimethyl-3-methylidene-2H,3H,3aH,4H,5H,8H,9H,12H,13H,15aH-cyclotetradeca[b]furan-2-one
Other name (4)：
  • (1R,2S,3E,7E,11E)センブラ-3,7,11,15-テトラエン-17,2-オリド
  • (1R,2S,3E,7E,11E)-Cembra-3,7,11,15-tetraen-17,2-olide
  • (3aR,6E,10E,14E)-3-Methylene-6,10,14-trimethyl-3aα,4,5,8,9,12,13,15aβ-octahydrocyclotetradeca[b]furan-2(3H)-one
  • (1S,2E,6E,10E,14R)-15-Methylene-3,7,11-trimethyl-17-oxabicyclo[12.3.0]heptadecane-2,6,10-triene-16-one
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