Chem
J-GLOBAL ID：200907032102433121   Nikkaji number：J1.279.734F

Eupaglehnin E

オイパグレーニンE
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： C17H23ClO6
Molecular formula furigana： C17-H23-CL-O6
Molecular weight： 358.820
InChI： InChI=1S/C17H23ClO6/c1-9-4-12(20)5-10(2)7-14-15(13(6-9)23-11(3)19)17(22,8-18)16(21)24-14/h4,7,12-15,20,22H,5-6,8H2,1-3H3/t12-,13?,14-,15-,17+/m1/s1
InChI key： LEQCGOCWIBCMAB-MEJROFLYSA-N
SMILES： CC(=O)OC1CC(=C[C@@H](O)CC(=C[C@H]2OC(=O)[C@](O)(CCl)[C@H]12)C)C
Systematic name  (3)：
  • (3S)-2-オキソ-3-(クロロメチル)-6,10-ジメチル-2,3,3aβ,4,5,8,9,11aα-オクタヒドロシクロデカ[b]フラン-3β,4α,8β-トリオール4-アセタート
  • (3S,3aR,4R,8S,11aR)-3-(クロロメチル)-3,8-ジヒドロキシ-6,10-ジメチル-2-オキソ-2H,3H,3aH,4H,5H,8H,9H,11aH-シクロデカ[b]フラン-4-イル アセタート
  • (3S,3aR,4R,8S,11aR)-3-(chloromethyl)-3,8-dihydroxy-6,10-dimethyl-2-oxo-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-4-yl acetate
Other name (3)：
  • (3S)-2-Oxo-3-(chloromethyl)-6,10-dimethyl-2,3,3aβ,4,5,8,9,11aα-octahydrocyclodeca[b]furan-3β,4α,8β-triol 4-acetate
  • オイパグレーニンE
  • Eupaglehnin E
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