Chem
J-GLOBAL ID：201507000862175326   Nikkaji number：J3.454.589H

1-[[1-(2-O,3-O,4-O,6-O-Tetraacetyl-β-D-galactopyranosyl)-1H-1,2,3-triazole-4-yl]methyl]pyrimidine-2,4(1H,3H)-dione

1-[[1-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシル)-1H-1,2,3-トリアゾール-4-イル]メチル]ピリミジン-2,4(1H,3H)-ジオン
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： C21H25N5O11
Molecular formula furigana： C21-H25-N5-O11
Molecular weight： 523.455
InChI： InChI=1S/C21H25N5O11/c1-10(27)33-9-15-17(34-11(2)28)18(35-12(3)29)19(36-13(4)30)20(37-15)26-8-14(23-24-26)7-25-6-5-16(31)22-21(25)32/h5-6,8,15,17-20H,7,9H2,1-4H3,(H,22,31,32)/t15-,17+,18+,19-,20-/m1/s1
InChI key： QLXQELLWPDBAFA-DABHTEOTSA-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(Cn2ccc(=O)[nH]c2=O)nn1
Systematic name  (3)：
  • 1-[[1-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシル)-1H-1,2,3-トリアゾール-4-イル]メチル]ピリミジン-2,4(1H,3H)-ジオン
  • [(2R,3S,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-{4-[(2,4-ジオキソ-1,2,3,4-テトラヒドロピリミジン-1-イル)メチル]-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,3S,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-{4-[(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)methyl]-1H-1,2,3-triazol-1-yl}oxan-2-yl]methyl acetate
Other name (1)：
  • 1-[[1-(2-O,3-O,4-O,6-O-Tetraacetyl-β-D-galactopyranosyl)-1H-1,2,3-triazole-4-yl]methyl]pyrimidine-2,4(1H,3H)-dione
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