Chemical Compound

J1.831.827J

J1.831.827J chemical structure
Primary Record

J1.831.827J

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
101211123
SMILES
CS[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)COC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-])OCC3=CC=CC=C3)OC(=O)C(Cl)(Cl)Cl)OC(=O)C4=CC=CC=C4
Canonical SMILES
CS[C@@H]1O[C@H](COC(=O)COc2ccc(C(=O)O)cc2[N+](=O)[O-])[C@@H](OCc2ccccc2)[C@H](OC(=O)C(Cl)(Cl)Cl)[C@H]1OC(=O)c1ccccc1

Names & Synonyms

  • J1.831.827J
  • 1-(Methylthio)-4-O-benzyl-6-O-(2-nitro-4-carboxyphenoxyacetyl)-1-deoxy-beta-D-glucopyranose 2-benzoate 3-(trichloroacetate)
  • 4-(2-{[(2R,3R,4S,5R,6S)-5-(benzoyloxy)-3-(benzyloxy)-6-(methylsulfanyl)-4-[(2,2,2-trichloroacetyl)oxy]oxan-2-yl]methoxy}-2-oxoethoxy)-3-nitrobenzoic acid