3-(D-Gluconoylamino)Propyl(2-Hydroxyethyl)Dimethylammonium Chloride
[CAS# 51812-80-7]

Identification

• Name: 3-(D-Gluconoylamino)Propyl(2-Hydroxyethyl)Dimethylammonium Chloride
• Synonyms: 2-Hydroxyethyl-Dimethyl-[3-[[(2R,3S,4R,5R)-2,3,4,5,6-Pentahydroxyhexanoyl]Amino]Propyl]Ammonium Chloride; 2-Hydroxyethyl-Dimethyl-[3-[[(2R,3S,4R,5R)-2,3,4,5,6-Pentahydroxy-1-Oxohexyl]Amino]Propyl]Ammonium Chloride; (Alpha-Gluconamidopropyl)Dimethyl-2-Hydroxyethylammonium Chloride
• Molecular Formula: C₁₃H₂₉ClN₂O₇
• Molecular Weight: 360.83
• CAS Registry Number: 51812-80-7
• EINECS: 257-440-3
• SMILES: [C@H](O)([C@H](O)[C@@H](O)C(=O)NCCC[N+](CCO)(C)C)[C@H](O)CO.[Cl-]
• InChI: 1S/C13H28N2O7.ClH/c1-15(2,6-7-16)5-3-4-14-13(22)12(21)11(20)10(19)9(18)8-17;/h9-12,16-21H,3-8H2,1-2H3;1H/t9-,10-,11+,12-;/m1./s1
• InChIKey: FVEWVVDBRQZLSJ-QTWKXRMISA-N