Chem
J-GLOBAL ID:200907099144660443   Nikkaji number:J2.392.421H

(1S)-1,5-Dideoxy-1-chloro-1-(2-cyanoethyl)-2-O,3-O-diacetyl-4-O-formyl-L-arabinitol

(3S,4R,5S,6S)-5-(アセチルオキシ)-3-クロロ-1-シアノ-6-(ホルミルオキシ)ヘプタン-4-イル アセタート
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: C13H18ClNO6
Molecular formula furigana: C13-H18-CL-N-O6
Molecular weight: 319.740
InChI: InChI=1S/C13H18ClNO6/c1-8(19-7-16)12(20-9(2)17)13(21-10(3)18)11(14)5-4-6-15/h7-8,11-13H,4-5H2,1-3H3/t8-,11-,12-,13-/m0/s1
InChI key: YQJKRPHFTQOVGK-WTFGDDLMSA-N
SMILES: C[C@H](OC=O)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H](Cl)CCC#N
Systematic name  (3):
  • (1S)-1,5-ジデオキシ-1-クロロ-1-(2-シアノエチル)-2-O,3-O-ジアセチル-4-O-ホルミル-L-アラビニトール
  • (3S,4R,5S,6S)-5-(アセチルオキシ)-3-クロロ-1-シアノ-6-(ホルミルオキシ)ヘプタン-4-イル アセタート
  • (3S,4R,5S,6S)-5-(acetyloxy)-3-chloro-1-cyano-6-(formyloxy)heptan-4-yl acetate
Other name (1):
  • (1S)-1,5-Dideoxy-1-chloro-1-(2-cyanoethyl)-2-O,3-O-diacetyl-4-O-formyl-L-arabinitol
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