Chem
J-GLOBAL ID:200907051543579061   Nikkaji number:J1.580.813F

1,6:2,3-Dianhydro-3-[(R)-fluoro(2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyl)methyl]-4-O-acetyl-β-D-gulopyranose

1,6:2,3-ジアンヒドロ-3-[(R)-フルオロ(2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシル)メチル]-4-O-アセチル-β-D-グロピラノース
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: C23H29FO14
Molecular formula furigana: C23-H29-F-O14
Molecular weight: 548.469
InChI: InChI=1S/C23H29FO14/c1-8(25)30-6-13-15(32-9(2)26)16(33-10(3)27)17(34-11(4)28)18(36-13)19(24)23-20(35-12(5)29)14-7-31-22(37-14)21(23)38-23/h13-22H,6-7H2,1-5H3/t13-,14-,15-,16+,17-,18-,19-,20+,21+,22-,23-/m1/s1
InChI key: NZKRVOQQOJSFGR-SYRZMUPPSA-N
SMILES: CC(=O)OC[C@H]1O[C@@H]([C@@H](F)[C@]23O[C@H]2[C@@H]2OC[C@@H](O2)[C@@H]3OC(=O)C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C
Systematic name  (3):
  • 1,6:2,3-ジアンヒドロ-3-[(R)-フルオロ(2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシル)メチル]-4-O-アセチル-β-D-グロピラノース
  • [(2R,3R,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-[(R)-[(1R,2R,4R,5S,6R)-5-(アセチルオキシ)-3,8,9-トリオキサトリシクロ[4.2.1.02,4]ノナン-4-イル](フルオロ)メチル]オキサン-2-イル]メチル アセタート
  • [(2R,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-[(R)-[(1R,2R,4R,5S,6R)-5-(acetyloxy)-3,8,9-trioxatricyclo[4.2.1.02,4]nonan-4-yl](fluoro)methyl]oxan-2-yl]methyl acetate
Other name (1):
  • 1,6:2,3-Dianhydro-3-[(R)-fluoro(2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyl)methyl]-4-O-acetyl-β-D-gulopyranose
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