Chem
J-GLOBAL ID：200907087568339930   Nikkaji number：J1.786.076C

Eupaglehnin A

オイパグレーニン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： C21H28O6
Molecular formula furigana： C21-H28-O6
Molecular weight： 376.449
InChI： InChI=1S/C21H28O6/c1-13-6-5-7-14(2)11-18(19-15(3)20(23)26-17(19)10-13)27-21(24)16(8-9-22)12-25-4/h7-8,10,17-19,22H,3,5-6,9,11-12H2,1-2,4H3/b13-10+,14-7+,16-8+/t17-,18-,19+/m1/s1
InChI key： OTWFEXKPUVHGDY-UZCYICRFSA-N
SMILES： COC/C(=C\CO)/C(=O)O[C@@H]1C/C(=C/CC/C(=C/[C@H]2OC(=O)C(=C)[C@H]12)/C)/C
Systematic name  (3)：
  • (3aR,4R,6E,10E,11aR)-3-メチレン-4-[[(E)-2-(メトキシメチル)-4-ヒドロキシ-2-ブテノイル]オキシ]-6,10-ジメチル-2,3,3a,4,5,8,9,11a-オクタヒドロシクロデカ[b]フラン-2-オン
  • (3aR,4R,11aR)-6,10-ジメチル-3-メチリデン-2-オキソ-2H,3H,3aH,4H,5H,8H,9H,11aH-シクロデカ[b]フラン-4-イル (2E)-4-ヒドロキシ-2-(メトキシメチル)ブタ-2-エノアート
  • (3aR,4R,11aR)-6,10-dimethyl-3-methylidene-2-oxo-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-4-yl (2E)-4-hydroxy-2-(methoxymethyl)but-2-enoate
Other name (3)：
  • (3aR,4R,6E,10E,11aR)-3-Methylene-4-[[(E)-2-(methoxymethyl)-4-hydroxy-2-butenoyl]oxy]-6,10-dimethyl-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-2-one
  • オイパグレーニンA
  • Eupaglehnin A
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