(2S,4S,5R,6R)-5-Acetamido-2-[4-[(5-Dimethylaminonaphthalen-1-Yl)Sulfonylamino]Phenyl]Sulfanyl-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]Oxane-2-Carboxylic Acid
[CAS# 141303-70-0]

Identification

• Name: (2S,4S,5R,6R)-5-Acetamido-2-[4-[(5-Dimethylaminonaphthalen-1-Yl)Sulfonylamino]Phenyl]Sulfanyl-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]Oxane-2-Carboxylic Acid
• Synonyms: (2S,4S,5R,6R)-5-Acetamido-2-[4-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]Phenyl]Sulfanyl-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]Tetrahydropyran-2-Carboxylic Acid; (2S,4S,5R,6R)-5-Acetamido-2-[[4-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]Phenyl]Thio]-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]-2-Tetrahydropyrancarboxylic Acid; (2S,4S,5R,6R)-5-Acetamido-2-[[4-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]Phenyl]Thio]-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]Tetrahydropyran-2-Carboxylic Acid
• Molecular Formula: C₂₉H₃₅N₃O₁₀S₂
• Molecular Weight: 649.73
• CAS Registry Number: 141303-70-0
• SMILES: [C@@]4(SC3=CC=C(N[S](C1=C2C(=CC=C1)C(=CC=C2)N(C)C)(=O)=O)C=C3)(O[C@@H]([C@@H]([C@@H](CO)O)O)[C@@H]([C@H](C4)O)NC(C)=O)C(=O)O
• InChI: 1S/C29H35N3O10S2/c1-16(34)30-25-22(35)14-29(28(38)39,42-27(25)26(37)23(36)15-33)43-18-12-10-17(11-13-18)31-44(40,41)24-9-5-6-19-20(24)7-4-8-21(19)32(2)3/h4-13,22-23,25-27,31,33,35-37H,14-15H2,1-3H3,(H,30,34)(H,38,39)/t22-,23+,25+,26+,27+,29-/m0/s1
• InChIKey: YRNBBVVAZPSEKQ-DWHFJZGISA-N