Chem
J-GLOBAL ID：200907081175763392   Nikkaji number：J2.117.961B

(3S)-3β-(6-O-β-D-Glucopyranosyl-D-glucopyranosyloxy)-4α-vinyl-8-oxo-4,4aβ,5,6-tetrahydro-3H,8H-pyrano[3,4-c]pyran

(3S)-3β-(6-O-β-D-グルコピラノシル-D-グルコピラノシルオキシ)-4α-ビニル-8-オキソ-4,4aβ,5,6-テトラヒドロ-3H,8H-ピラノ[3,4-c]ピラン
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： C22H32O14
Molecular formula furigana： C22-H32-O14
Molecular weight： 520.484
InChI： InChI=1S/C22H32O14/c1-2-8-9-3-4-31-19(30)10(9)6-32-20(8)36-22-18(29)16(27)14(25)12(35-22)7-33-21-17(28)15(26)13(24)11(5-23)34-21/h2,6,8-9,11-18,20-29H,1,3-5,7H2/t8-,9+,11-,12-,13-,14-,15+,16+,17-,18-,20+,21-,22?/m1/s1
InChI key： LILOLDYAQAFVGN-FTRJRRDTSA-N
SMILES： OC[C@H]1O[C@@H](OC[C@H]2OC(O[C@@H]3OC=C4[C@@H](CCOC4=O)[C@H]3C=C)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • (3S)-3β-(6-O-β-D-グルコピラノシル-D-グルコピラノシルオキシ)-4α-ビニル-8-オキソ-4,4aβ,5,6-テトラヒドロ-3H,8H-ピラノ[3,4-c]ピラン
  • (4aS,5R,6S)-5-エテニル-6-{[(3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-({[(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}メチル)オキサン-2-イル]オキシ}-1H,3H,4H,4aH,5H,6H-ピラノ[3,4-c]ピラン-1-オン
  • (4aS,5R,6S)-5-ethenyl-6-{[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1H,3H,4H,4aH,5H,6H-pyrano[3,4-c]pyran-1-one
Other name (1)：
  • (3S)-3β-(6-O-β-D-Glucopyranosyl-D-glucopyranosyloxy)-4α-vinyl-8-oxo-4,4aβ,5,6-tetrahydro-3H,8H-pyrano[3,4-c]pyran
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