Chem
J-GLOBAL ID：201707001339083796   Nikkaji number：J3.575.221H

1-(2-O,3-O,4-O,6-O-Tetraacetyl-β-D-glucopyranosyl)-4-(4-bromophenyl)-1H-1,2,3-triazole

1-(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)-4-(4-ブロモフェニル)-1H-1,2,3-トリアゾール
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： C22H24BrN3O9
Molecular formula furigana： C22-H24-BR-N3-O9
Molecular weight： 554.350
InChI： InChI=1S/C22H24BrN3O9/c1-11(27)31-10-18-19(32-12(2)28)20(33-13(3)29)21(34-14(4)30)22(35-18)26-9-17(24-25-26)15-5-7-16(23)8-6-15/h5-9,18-22H,10H2,1-4H3/t18-,19-,20+,21-,22-/m1/s1
InChI key： KSGKHHWJUNVOFY-QMCAAQAGSA-N
SMILES： CC(=O)OC[C@H]1O[C@H]([C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C)n1cc(nn1)c1ccc(Br)cc1
Systematic name  (3)：
  • 1-(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)-4-(4-ブロモフェニル)-1H-1,2,3-トリアゾール
  • [(2R,3R,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-[4-(4-ブロモフェニル)-1H-1,2,3-トリアゾール-1-イル]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-[4-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]oxan-2-yl]methyl acetate
Other name (1)：
  • 1-(2-O,3-O,4-O,6-O-Tetraacetyl-β-D-glucopyranosyl)-4-(4-bromophenyl)-1H-1,2,3-triazole
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