Chemical Compound

J1.743.822K

J1.743.822K chemical structure
Primary Record

J1.743.822K

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177417736
SMILES
C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)COC(=O)C)OC(=O)C)OO[C@@]4(C[C@@H]([C@H]([C@@H](O4)[C@@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)N)OC(=O)C)C(=O)OC)OC(=O)C)COC(=O)C)O[C@H]5[C@H]([C@H](O[C@H]([C@@H]5OC(=O)C)O[C@@H]6[C@H](O[C@H]([C@H]([C@H]6OC(=O)C)OC(=O)C7=CC=CC=C7)OC(=N)C(Cl)(Cl)Cl)COC(=O)C)COC(=O)C)OC(=O)C)NC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
Canonical SMILES
COC(=O)[C@@]1(OO[C@H]2[C@@H](OC(C)=O)[C@@H](COC(C)=O)O[C@@H](O[C@H]3[C@H](O[C@@H]4O[C@@H](C)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]4OC(C)=O)[C@@H](NC(C)=O)[C@H](O[C@H]4[C@@H](OC(C)=O)[C@@H](COC(C)=O)O[C@@H](O[C@H]5[C@H](OC(C)=O)[C@H](OC(=O)c6ccccc6)[C@H](OC(=N)C(Cl)(Cl)Cl)O[C@@H]5COC(C)=O)[C@@H]4OC(C)=O)O[C@@H]3COC(C)=O)[C@@H]2OC(C)=O)C[C@H](OC(C)=O)[C@@H](N)[C@H]([C@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O)O1

Names & Synonyms

  • J1.743.822K
  • 2-O-[1-O-[1-O-[1-O-[1-O-(1-Imino-2,2,2-trichloroethyl)-2-O-benzoyl-3-O,6-O-diacetyl-4-deoxy-beta-D-mannopyranose-4-yl]-2-O,4-O,6-O-triacetyl-3-deoxy-beta-D-galactopyranose-3-yl]-3-O-(2-O,3-O,4-O-triacetyl-alpha-L-fucopyranosyl)-6-O-acetyl-2-(acetylamino)-2,4-dideoxy-beta-D-glucopyranose-4-yl]-2-O,4-O,6-O-triacetyl-beta-D-galactopyranose-3-O-yl]-4-O,7-O,8-O,9-O-tetraacetyl-alpha-neuraminic acid methyl ester
  • methyl (2S,4S,5R,6R)-4-(acetyloxy)-5-amino-2-{[(2R,3S,4S,5R,6S)-3,5-bis(acetyloxy)-2-[(acetyloxy)methyl]-6-{[(2R,3S,4R,5R,6S)-2-[(acetyloxy)methyl]-6-{[(2S,3R,4S,5S,6R)-3,5-bis(acetyloxy)-2-{[(2R,3R,4S,5S,6S)-4-(acetyloxy)-2-[(acetyloxy)methyl]-5-(benzoyloxy)-6-[(2,2,2-trichloroethanimidoyl)oxy]oxan-3-yl]oxy}-6-[(acetyloxy)methyl]oxan-4-yl]oxy}-5-acetamido-4-{[(2S,3S,4R,5R,6S)-3,4,5-tris(acetyloxy)-6-methyloxan-2-yl]oxy}oxan-3-yl]oxy}oxan-4-yl]peroxy}-6-[(1S,2R)-1,2,3-tris(acetyloxy)propyl]oxane-2-carboxylate