Chem
J-GLOBAL ID：200907061452513560   Nikkaji number：J1.387.332A

Xeniolide A

キセニオリド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： C20H28O4
Molecular formula furigana： C20-H28-O4
Molecular weight： 332.440
InChI： InChI=1S/C20H28O4/c1-13-7-8-16-17(6-5-9-20(3,4)23)19(22)24-12-18(16)14(2)11-15(21)10-13/h5-6,9-10,15-16,18,21,23H,2,7-8,11-12H2,1,3-4H3/b9-5+,13-10+,17-6-/t15-,16+,18-/m0/s1
InChI key： ZHNTWXWAMWPYNI-VRKFFOFISA-N
SMILES： C/C/1=C\[C@H](O)CC(=C)[C@@H]2COC(=O)/C(=C\C=C\C(C)(C)O)/[C@H]2CC1
Systematic name  (3)：
  • (4Z,4aS,7E)-4-[(2E)-4-メチル-4-ヒドロキシ-2-ペンテニリデン]-7-メチル-9α-ヒドロキシ-11-メチレン-4,4aα,5,6,9,10,11,11aβ-オクタヒドロシクロノナ[c]ピラン-3(1H)-オン
  • (4Z,4aS,9R,11aR)-9-ヒドロキシ-4-[(2E)-4-ヒドロキシ-4-メチルペンタ-2-エン-1-イリデン]-7-メチル-11-メチリデン-1H,3H,4H,4aH,5H,6H,9H,10H,11H,11aH-シクロノナ[c]ピラン-3-オン
  • (4Z,4aS,9R,11aR)-9-hydroxy-4-[(2E)-4-hydroxy-4-methylpent-2-en-1-ylidene]-7-methyl-11-methylidene-1H,3H,4H,4aH,5H,6H,9H,10H,11H,11aH-cyclonona[c]pyran-3-one
Other name (3)：
  • (4Z,4aS,7E)-4-[(2E)-4-Methyl-4-hydroxy-2-pentenylidene]-7-methyl-9α-hydroxy-11-methylene-4,4aα,5,6,9,10,11,11aβ-octahydrocyclonona[c]pyran-3(1H)-one
  • キセニオリドA
  • Xeniolide A
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