Chem
J-GLOBAL ID：200907085750407256   Nikkaji number：J2.103.548C

4-O-(α-D-Glucopyranosyl)-6-O-[6-(vinyloxy)-1,6-dioxohexyl]-D-glucitol

4-O-(α-D-グルコピラノシル)-6-O-[6-(ビニルオキシ)-1,6-ジオキソヘキシル]-D-グルシトール
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： C20H34O14
Molecular formula furigana： C20-H34-O14
Molecular weight： 498.478
InChI： InChI=1S/C20H34O14/c1-2-31-13(25)5-3-4-6-14(26)32-9-11(24)19(15(27)10(23)7-21)34-20-18(30)17(29)16(28)12(8-22)33-20/h2,10-12,15-24,27-30H,1,3-9H2/t10-,11+,12+,15+,16+,17-,18+,19+,20+/m0/s1
InChI key： YJXPBGHVQIWAOK-SHIMAPSASA-N
SMILES： OC[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)COC(=O)CCCCC(=O)OC=C
Systematic name  (4)：
  • ヘキサン二酸1-ビニル6-[(2R,3R,4R,5S)-2,4,5,6-テトラヒドロキシ-3-(α-D-グルコピラノシルオキシ)ヘキシル]
  • 4-O-(α-D-グルコピラノシル)-6-O-[6-(ビニルオキシ)-1,6-ジオキソヘキシル]-D-グルシトール
  • 1-エテニル 6-(2R,3R,4R,5S)-2,4,5,6-テトラヒドロキシ-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}ヘキシル ヘキサンジオアート
  • 1-ethenyl 6-(2R,3R,4R,5S)-2,4,5,6-tetrahydroxy-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexyl hexanedioate
Other name (2)：
  • Hexanedioic acid 1-vinyl 6-[(2R,3R,4R,5S)-2,4,5,6-tetrahydroxy-3-(α-D-glucopyranosyloxy)hexyl] ester
  • 4-O-(α-D-Glucopyranosyl)-6-O-[6-(vinyloxy)-1,6-dioxohexyl]-D-glucitol
Thsaurus map：
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