4-(Trifluoroacetamido)Phenyl-2-Acetamido-2-Deoxy-4-O-beta-Mannopyranosyl-beta-Glucopyranoside
[CAS# 92689-45-7]

Identification

• Name: 4-(Trifluoroacetamido)Phenyl-2-Acetamido-2-Deoxy-4-O-beta-Mannopyranosyl-beta-Glucopyranoside
• Synonyms: N-[4-[(2S,3R,4R,6R)-3-Acetamido-4-Hydroxy-6-(Hydroxymethyl)-5-[(2S,3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxyphenyl]-2,2,2-Trifluoro-Acetamide; N-[4-[[(2S,3R,4R,6R)-3-Acetamido-4-Hydroxy-6-(Hydroxymethy
• Molecular Formula: C₂₂H₂₉F₃N₂O₁₂
• Molecular Weight: 570.47
• CAS Registry Number: 92689-45-7
• SMILES: [C@@H]1([C@@H]([C@H](O[C@H]([C@H]1O)OC2[C@@H]([C@H]([C@@H](O[C@@H]2CO)OC3=CC=C(C=C3)NC(C(F)(F)F)=O)NC(=O)C)O)CO)O)O
• InChI: 1S/C22H29F3N2O12/c1-8(30)26-13-15(32)18(39-20-17(34)16(33)14(31)11(6-28)37-20)12(7-29)38-19(13)36-10-4-2-9(3-5-10)27-21(35)22(23,24)25/h2-5,11-20,28-29,31-34H,6-7H2,1H3,(H,26,30)(H,27,35)/t11-,12-,13-,14-,15-,16+,17+,18?,19-,20+/m1/s1
• InChIKey: SJWYSIVCIHYIKL-OYKAZAFASA-N

Properties

• Density: 1.623g/cm³ (Cal.)
• Boiling point: 880.19°C at 760 mmHg (Cal.)
• Flash point: 486.121°C (Cal.)