Chem
J-GLOBAL ID:200907048577189814   Nikkaji number:J280.258I

1-O,6-O:2-O,3-O:4-O,5-O-Tris(4-chlorobenzylidene)-D-glucitol

1-O,6-O:2-O,3-O:4-O,5-O-トリス(4-クロロベンジリデン)-D-ソルビトール
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: C27H23Cl3O6
Molecular formula furigana: C27-H23-CL3-O6
Molecular weight: 549.830
InChI: InChI=1S/C27H23Cl3O6/c28-18-7-1-15(2-8-18)25-31-13-21-23(35-26(33-21)16-3-9-19(29)10-4-16)24-22(14-32-25)34-27(36-24)17-5-11-20(30)12-6-17/h1-12,21-27H,13-14H2/t21-,22+,23-,24-,25?,26?,27?/m1/s1
InChI key: GBIQBJBPAKWBIQ-RTPUBYHCSA-N
SMILES: Clc1ccc(cc1)C1O[C@@H]2COC(OC[C@@H]3OC(O[C@H]3[C@@H]2O1)c1ccc(Cl)cc1)c1ccc(Cl)cc1
Systematic name  (3):
  • 1-O,6-O:2-O,3-O:4-O,5-O-トリス(4-クロロベンジリデン)-D-グルシトール
  • (1R,2R,6R,12S)-4,9,14-トリス(4-クロロフェニル)-3,5,8,10,13,15-ヘキサオキサトリシクロ[10.3.0.02,6]ペンタデカン
  • (1R,2R,6R,12S)-4,9,14-tris(4-chlorophenyl)-3,5,8,10,13,15-hexaoxatricyclo[10.3.0.02,6]pentadecane
Other name (3):
  • 1-O,6-O:2-O,3-O:4-O,5-O-Tris(4-chlorobenzylidene)-D-sorbitol
  • 1-O,6-O:2-O,3-O:4-O,5-O-トリス(4-クロロベンジリデン)-D-ソルビトール
  • 1-O,6-O:2-O,3-O:4-O,5-O-Tris(4-chlorobenzylidene)-D-glucitol
Regulation number (1):
  • (5)-3762
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