Chem
J-GLOBAL ID：200907091459856183   Nikkaji number：J16.288D

Autumnolide

アウツムノリド
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： C15H20O5
Molecular formula furigana： C15-H20-O5
Molecular weight： 280.320
InChI： InChI=1S/C15H20O5/c1-5-4-7-8(6(2)14(18)19-7)12(16)15(3)9(5)10-11(20-10)13(15)17/h5,7-13,16-17H,2,4H2,1,3H3/t5-,7-,8-,9-,10-,11-,12+,13+,15-/m1/s1
InChI key： NWSWVIKHALGAER-KVLFNOHQSA-N
SMILES： C[C@@H]1C[C@H]2OC(=O)C(=C)[C@H]2[C@H](O)[C@]2(C)[C@@H](O)[C@@H]3O[C@@H]3[C@@H]12
Systematic name  (3)：
  • (1aR,1bα,3aα,6aα,8aβ)-ドデカヒドロ-7α,8β-ジヒドロキシ-2α,7aβ-ジメチル-6-メチレンオキシレノ[1,2]アズレノ[6,5-b]フラン-5-オン
  • (1R,2S,3S,7R,9R,10S,11R,13S,14R)-2,14-ジヒドロキシ-1,9-ジメチル-4-メチリデン-6,12-ジオキサテトラシクロ[8.4.0.03,7.011,13]テトラデカン-5-オン
  • (1R,2S,3S,7R,9R,10S,11R,13S,14R)-2,14-dihydroxy-1,9-dimethyl-4-methylidene-6,12-dioxatetracyclo[8.4.0.03,7.011,13]tetradecan-5-one
Other name (4)：
  • アウツムノリド
  • オウタムノリド
  • Autumnolide
  • (1aR,1bα,3aα,6aα,8aβ)-Dodecahydro-7α,8β-dihydroxy-2α,7aβ-dimethyl-6-methyleneoxireno[1,2]azuleno[6,5-b]furan-5-one
CAS registry number： 20505-32-2
KEGG COMPOUND： C09346
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