Chem
J-GLOBAL ID：200907014724536795   Nikkaji number：J2.176.841C

Pukalide aldehyde

プカリドアルデヒド
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： C20H22O5
Molecular formula furigana： C20-H22-O5
Molecular weight： 342.391
InChI： InChI=1S/C20H22O5/c1-11(2)12-4-5-13-6-15(23-19(13)22)9-20(3)18(25-20)17-8-14(10-21)16(7-12)24-17/h6,8,10,12,15,18H,1,4-5,7,9H2,2-3H3/t12-,15-,18+,20-/m1/s1
InChI key： CDYDRAISDJZNIZ-OEOGJYLISA-N
SMILES： CC(=C)[C@@H]1CCC2=C[C@H](C[C@@]3(C)O[C@H]3c3cc(C=O)c(C1)o3)OC2=O
Systematic name  (3)：
  • (1S,3R,4R,10R)-14-オキソ-3-メチル-10-イソプロペニル-3,4-エポキシ-15,17-ジオキサトリシクロ[11.2.1.15,8]ヘプタデカ-5,7,13(16)-トリエン-7-カルボアルデヒド
  • (2R,4R,6S,12R)-4-メチル-8-オキソ-12-(プロパ-1-エン-2-イル)-3,7,17-トリオキサテトラシクロ[12.2.1.16,9.02,4]オクタデカ-1(16),9(18),14-トリエン-15-カルバルデヒド
  • (2R,4R,6S,12R)-4-methyl-8-oxo-12-(prop-1-en-2-yl)-3,7,17-trioxatetracyclo[12.2.1.16,9.02,4]octadeca-1(16),9(18),14-triene-15-carbaldehyde
Other name (3)：
  • (1S,3R,4R,10R)-14-Oxo-3-methyl-10-isopropenyl-3,4-epoxy-15,17-dioxatricyclo[11.2.1.15,8]heptadeca-5,7,13(16)-triene-7-carbaldehyde
  • Pukalide aldehyde
  • プカリドアルデヒド
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