Chem
J-GLOBAL ID:200907096392843121   Nikkaji number:J1.160.638E

4-O-(β-D-Glucopyranosyl)-6-O-methyl-β-D-glucopyranosyl fluoride

4-O-(β-D-グルコピラノシル)-6-O-メチル-β-D-グルコピラノシルフルオリド
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: C13H23FO10
Molecular formula furigana: C13-H23-F-O10
Molecular weight: 358.315
InChI: InChI=1S/C13H23FO10/c1-21-3-5-11(8(18)9(19)12(14)22-5)24-13-10(20)7(17)6(16)4(2-15)23-13/h4-13,15-20H,2-3H2,1H3/t4-,5-,6-,7+,8-,9-,10-,11-,12-,13+/m1/s1
InChI key: USNXWFTYORAIPK-VJNWNIOVSA-N
SMILES: COC[C@H]1O[C@@H](F)[C@H](O)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3):
  • 4-O-(β-D-グルコピラノシル)-6-O-メチル-β-D-グルコピラノシルフルオリド
  • (2S,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6S)-6-フルオロ-4,5-ジヒドロキシ-2-(メトキシメチル)オキサン-3-イル]オキシ}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
  • (2S,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6S)-6-fluoro-4,5-dihydroxy-2-(methoxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
  • 4-O-(β-D-Glucopyranosyl)-6-O-methyl-β-D-glucopyranosyl fluoride
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