Chem
J-GLOBAL ID:200907054541158815   Nikkaji number:J2.619.045B

1-O-Allyl-N-(trichloroacetyl)-3-O,4-O,6-O-triacetyl-β-D-glucosamine

1-O-アリル-N-(トリクロロアセチル)-3-O,4-O,6-O-トリアセチル-β-D-グルコサミン
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: C17H22Cl3NO9
Molecular formula furigana: C17-H22-CL3-N-O9
Molecular weight: 490.710
InChI: InChI=1S/C17H22Cl3NO9/c1-5-6-26-15-12(21-16(25)17(18,19)20)14(29-10(4)24)13(28-9(3)23)11(30-15)7-27-8(2)22/h5,11-15H,1,6-7H2,2-4H3,(H,21,25)/t11-,12-,13-,14-,15-/m1/s1
InChI key: XFNLWZCTEDTRGB-KJWHEZOQSA-N
SMILES: CC(=O)OC[C@H]1O[C@@H](OCC=C)[C@H](NC(=O)C(Cl)(Cl)Cl)[C@@H](OC(=O)C)[C@@H]1OC(=O)C
Systematic name  (3):
  • 1-O-アリル-N-(トリクロロアセチル)-3-O,4-O,6-O-トリアセチル-β-D-グルコサミン
  • [(2R,3S,4R,5R,6R)-3,4-ビス(アセチルオキシ)-6-(プロパ-2-エン-1-イルオキシ)-5-(2,2,2-トリクロロアセトアミド)オキサン-2-イル]メチル アセタート
  • [(2R,3S,4R,5R,6R)-3,4-bis(acetyloxy)-6-(prop-2-en-1-yloxy)-5-(2,2,2-trichloroacetamido)oxan-2-yl]methyl acetate
Other name (1):
  • 1-O-Allyl-N-(trichloroacetyl)-3-O,4-O,6-O-triacetyl-β-D-glucosamine
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