Chem
J-GLOBAL ID:200907098720109921   Nikkaji number:J1.583.867A

N-(β-D-Glucopyranosyl)-2,2,2-trifluoroacetamide

N-(β-D-グルコピラノシル)-2,2,2-トリフルオロアセトアミド
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: C8H12F3NO6
Molecular formula furigana: C8-H12-F3-N-O6
Molecular weight: 275.180
InChI: InChI=1S/C8H12F3NO6/c9-8(10,11)7(17)12-6-5(16)4(15)3(14)2(1-13)18-6/h2-6,13-16H,1H2,(H,12,17)/t2-,3-,4+,5-,6-/m1/s1
InChI key: XMUBEPVSEUVEBW-VFUOTHLCSA-N
SMILES: OC[C@H]1O[C@@H](NC(=O)C(F)(F)F)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3):
  • N-(β-D-グルコピラノシル)-2,2,2-トリフルオロアセトアミド
  • 2,2,2-トリフルオロ-N-[(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]アセトアミド
  • 2,2,2-trifluoro-N-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]acetamide
Other name (1):
  • N-(β-D-Glucopyranosyl)-2,2,2-trifluoroacetamide
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