Chem
J-GLOBAL ID:200907049844354850   Nikkaji number:J1.826.777B

1-(2-Ethynyl-4-fluorophenyl)-3-O,5-O-bis(4-chlorobenzoyl)-1,2-dideoxy-β-D-erythro-pentofuranose

1-(2-エチニル-4-フルオロフェニル)-3-O,5-O-ビス(4-クロロベンゾイル)-1,2-ジデオキシ-β-D-erythro-ペントフラノース
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: C27H19Cl2FO5
Molecular formula furigana: C27-H19-CL2-F-O5
Molecular weight: 513.340
InChI: InChI=1S/C27H19Cl2FO5/c1-2-16-13-21(30)11-12-22(16)23-14-24(35-27(32)18-5-9-20(29)10-6-18)25(34-23)15-33-26(31)17-3-7-19(28)8-4-17/h1,3-13,23-25H,14-15H2/t23-,24+,25-/m1/s1
InChI key: KUTAWDUWDOIZDU-DSNGMDLFSA-N
SMILES: Fc1ccc([C@H]2C[C@H](OC(=O)c3ccc(Cl)cc3)[C@@H](COC(=O)c3ccc(Cl)cc3)O2)c(c1)C#C
Systematic name  (3):
  • 1-(2-エチニル-4-フルオロフェニル)-3-O,5-O-ビス(4-クロロベンゾイル)-1,2-ジデオキシ-β-D-erythro-ペントフラノース
  • (2R,3S,5R)-2-[(4-クロロベンゾイルオキシ)メチル]-5-(2-エチニル-4-フルオロフェニル)オキソラン-3-イル 4-クロロベンゾアート
  • (2R,3S,5R)-2-[(4-chlorobenzoyloxy)methyl]-5-(2-ethynyl-4-fluorophenyl)oxolan-3-yl 4-chlorobenzoate
Other name (1):
  • 1-(2-Ethynyl-4-fluorophenyl)-3-O,5-O-bis(4-chlorobenzoyl)-1,2-dideoxy-β-D-erythro-pentofuranose
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