Chem
J-GLOBAL ID：200907004799966846   Nikkaji number：J17.451C

Cornoside

コルノシド
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： C14H20O8
Molecular formula furigana： C14-H20-O8
Molecular weight： 316.306
InChI： InChI=1S/C14H20O8/c15-7-9-10(17)11(18)12(19)13(22-9)21-6-5-14(20)3-1-8(16)2-4-14/h1-4,9-13,15,17-20H,5-7H2/t9-,10-,11+,12-,13-/m1/s1
InChI key： VTVARPTUBCBNJX-UJPOAAIJSA-N
SMILES： OC[C@H]1O[C@@H](OCCC2(O)C=CC(=O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (4)：
  • 4-ヒドロキシ-4-[2-(β-D-グルコピラノシルオキシ)エチル]-2,5-シクロヘキサジエン-1-オン
  • 4-[2-(β-D-グルコピラノシルオキシ)エチル]-4-ヒドロキシ-2,5-シクロヘキサジエン-1-オン
  • 4-ヒドロキシ-4-(2-{[(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}エチル)シクロヘキサ-2,5-ジエン-1-オン
  • 4-hydroxy-4-(2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)cyclohexa-2,5-dien-1-one
Other name (3)：
  • コルノシド
  • Cornoside
  • 4-[2-(β-D-Glucopyranosyloxy)ethyl]-4-hydroxy-2,5-cyclohexadien-1-one
CAS registry number： 40661-45-8
Thsaurus map：
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