Chem
J-GLOBAL ID:200907025815127970   Nikkaji number:J1.512.984K

1-O,2-O,3-O,4-O,6-O-Pentakis(4-fluorobenzoyl)-D-glucopyranose

1-O,2-O,3-O,4-O,6-O-ペンタキス(4-フルオロベンゾイル)-D-グルコピラノース
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: C41H27F5O11
Molecular formula furigana: C41-H27-F5-O11
Molecular weight: 790.648
InChI: InChI=1S/C41H27F5O11/c42-27-11-1-22(2-12-27)36(47)52-21-32-33(54-37(48)23-3-13-28(43)14-4-23)34(55-38(49)24-5-15-29(44)16-6-24)35(56-39(50)25-7-17-30(45)18-8-25)41(53-32)57-40(51)26-9-19-31(46)20-10-26/h1-20,32-35,41H,21H2/t32-,33-,34+,35-,41?/m1/s1
InChI key: DDIUUDNOOKPJNH-XBHBEMSESA-N
SMILES: Fc1ccc(cc1)C(=O)OC[C@H]1OC(OC(=O)c2ccc(F)cc2)[C@H](OC(=O)c2ccc(F)cc2)[C@@H](OC(=O)c2ccc(F)cc2)[C@@H]1OC(=O)c1ccc(F)cc1
Systematic name  (3):
  • 1-O,2-O,3-O,4-O,6-O-ペンタキス(4-フルオロベンゾイル)-D-グルコピラノース
  • [(2R,3R,4S,5R)-3,4,5,6-テトラキス(4-フルオロベンゾイルオキシ)オキサン-2-イル]メチル 4-フルオロベンゾアート
  • [(2R,3R,4S,5R)-3,4,5,6-tetrakis(4-fluorobenzoyloxy)oxan-2-yl]methyl 4-fluorobenzoate
Other name (1):
  • 1-O,2-O,3-O,4-O,6-O-Pentakis(4-fluorobenzoyl)-D-glucopyranose
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