Chem
J-GLOBAL ID：200907022527759335   Nikkaji number：J1.403.001H

Ascleposide E

アスクレポシド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： C19H32O8
Molecular formula furigana： C19-H32-O8
Molecular weight： 388.457
InChI： InChI=1S/C19H32O8/c1-10(21)4-5-13-18(2)6-11(7-19(13,3)25-9-18)26-17-16(24)15(23)14(22)12(8-20)27-17/h11-17,20,22-24H,4-9H2,1-3H3/t11-,12+,13+,14+,15-,16+,17+,18+,19+/m0/s1
InChI key： FUGMJWOONJABQQ-QUQGRMMRSA-N
SMILES： CC(=O)CC[C@@H]1[C@@]2(C)CO[C@]1(C)C[C@H](C2)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • 4-[(1S,3S,5R,8R)-1,5-ジメチル-3-(β-D-グルコピラノシルオキシ)-6-オキサビシクロ[3.2.1]オクタン-8-イル]-2-ブタノン
  • 4-[(1S,3S,5R,8R)-1,5-ジメチル-3-{[(2R,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-6-オキサビシクロ[3.2.1]オクタン-8-イル]ブタン-2-オン
  • 4-[(1S,3S,5R,8R)-1,5-dimethyl-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-oxabicyclo[3.2.1]octan-8-yl]butan-2-one
Other name (3)：
  • 4-[(1S,3S,5R,8R)-1,5-Dimethyl-3-(β-D-glucopyranosyloxy)-6-oxabicyclo[3.2.1]octane-8-yl]-2-butanone
  • アスクレポシドE
  • Ascleposide E
Thsaurus map：
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