Chem
J-GLOBAL ID：200907096645973205   Nikkaji number：J1.019.329J

4-O-(2-O,3-O,4-O,6-O-Tetrabenzyl-α-D-glucopyranosyl)-1,6:2,3-dianhydro-β-D-mannopyranose

4-O-(2-O,3-O,4-O,6-O-テトラベンジル-α-D-グルコピラノシル)-1,6:2,3-ジアンヒドロ-β-D-マンノピラノース
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： C40H42O9
Molecular formula furigana： C40-H42-O9
Molecular weight： 666.767
InChI： InChI=1S/C40H42O9/c1-5-13-27(14-6-1)21-41-25-31-33(42-22-28-15-7-2-8-16-28)35(43-23-29-17-9-3-10-18-29)37(44-24-30-19-11-4-12-20-30)40(47-31)49-34-32-26-45-39(46-32)38-36(34)48-38/h1-20,31-40H,21-26H2/t31-,32-,33-,34-,35+,36+,37-,38+,39-,40-/m1/s1
InChI key： OVRPIZYCCMOMIZ-MNBVTPLMSA-N
SMILES： C(OCc1ccccc1)[C@H]1O[C@H](O[C@H]2[C@@H]3O[C@@H]3[C@@H]3OC[C@H]2O3)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1
Systematic name  (3)：
  • 4-O-(2-O,3-O,4-O,6-O-テトラベンジル-α-D-グルコピラノシル)-1,6:2,3-ジアンヒドロ-β-D-マンノピラノース
  • (1R,2S,4S,5R,6R)-5-{[(2R,3R,4S,5R,6R)-3,4,5-トリス(ベンジルオキシ)-6-[(ベンジルオキシ)メチル]オキサン-2-イル]オキシ}-3,8,9-トリオキサトリシクロ[4.2.1.02,4]ノナン
  • (1R,2S,4S,5R,6R)-5-{[(2R,3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-[(benzyloxy)methyl]oxan-2-yl]oxy}-3,8,9-trioxatricyclo[4.2.1.02,4]nonane
Other name (1)：
  • 4-O-(2-O,3-O,4-O,6-O-Tetrabenzyl-α-D-glucopyranosyl)-1,6:2,3-dianhydro-β-D-mannopyranose
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