Chemical Compound

J3.439.257I

J3.439.257I chemical structure
Primary Record

J3.439.257I

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
122389775
SMILES
CCOP(=O)(CP(=O)(OCC)O[C@@H]1[C@@H](C([C@H]([C@@H](C1OCC2=CC=CC=C2)OP(=O)(CP(=O)(OCC)OCC)OCC)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC
Canonical SMILES
CCOP(=O)(CP(=O)(OCC)O[C@@H]1C(OCc2ccccc2)[C@H](OP(=O)(CP(=O)(OCC)OCC)OCC)[C@H](OCc2ccccc2)C(OCc2ccccc2)[C@H]1OCc1ccccc1)OCC

Names & Synonyms

  • J3.439.257I
  • 2-O,3-O,4-O,6-O-Tetrabenzyl-D-myo-inositol 1,5-bis(methylenebisphosphonic acid)hexaethyl ester
  • diethyl {[ethoxy({[(1S,2R,3R,4R,5R)-2,3,4,6-tetrakis(benzyloxy)-5-({[(diethoxyphosphoryl)methyl](ethoxy)phosphoryl}oxy)cyclohexyl]oxy})phosphoryl]methyl}phosphonate