N-[5-Amino-2-[3-(Aminomethyl)-4,5,6-Trihydroxyoxan-2-Yl]Oxy-4-[3,5-Dihydroxy-6-(Hydroxymethyl)-4-[(2,2,2-Trifluoroacetyl)Amino]Oxan-2-Yl]Oxy-3-Hydroxycyclohexyl]Hexadecanamide
[CAS# 106190-45-8]

Identification

• Name: N-[5-Amino-2-[3-(Aminomethyl)-4,5,6-Trihydroxyoxan-2-Yl]Oxy-4-[3,5-Dihydroxy-6-(Hydroxymethyl)-4-[(2,2,2-Trifluoroacetyl)Amino]Oxan-2-Yl]Oxy-3-Hydroxycyclohexyl]Hexadecanamide
• Synonyms: N-[5-Amino-2-[3-(Aminomethyl)-4,5,6-Trihydroxy-Tetrahydropyran-2-Yl]Oxy-4-[3,5-Dihydroxy-6-(Hydroxymethyl)-4-[(2,2,2-Trifluoroacetyl)Amino]Tetrahydropyran-2-Yl]Oxy-3-Hydroxy-Cyclohexyl]Hexadecanamide; N-[5-Amino-2-[[3-(Aminomethyl)-4,5,6-Trihydroxy-2-Tetrahydropyranyl]Oxy]-4-[[3,5-Dihydroxy-6-(Hydroxymethyl)-4-[(2,2,2-Trifluoro-1-Oxoethyl)Amino]-2-Tetrahydropyranyl]Oxy]-3-Hydroxycyclohexyl]Hexadecanamide; N-[5-Amino-2-[3-(Aminomethyl)-4,5,6-Trihydroxy-Tetrahydropyran-2-Yl]Oxy-4-[3,5-Dihydroxy-6-Methylol-4-[(2,2,2-Trifluoroacetyl)Amino]Tetrahydropyran-2-Yl]Oxy-3-Hydroxy-Cyclohexyl]Palmitamide
• Molecular Formula: C₃₆H₆₅F₃N₄O₁₃
• Molecular Weight: 818.92
• CAS Registry Number: 106190-45-8
• SMILES: C(C1C(C(C(C(O1)OC2C(C(C(CC2N)NC(=O)CCCCCCCCCCCCCCC)OC3OC(C(C(C3CN)O)O)O)O)O)NC(C(F)(F)F)=O)O)O
• InChI: 1S/C36H65F3N4O13/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23(45)42-21-16-20(41)30(29(50)31(21)55-33-19(17-40)25(46)28(49)32(51)56-33)54-34-27(48)24(26(47)22(18-44)53-34)43-35(52)36(37,38)39/h19-22,24-34,44,46-51H,2-18,40-41H2,1H3,(H,42,45)(H,43,52)
• InChIKey: FGENLTKUTXNKQY-UHFFFAOYSA-N

Properties

• Density: 1.359g/cm³ (Cal.)
• Boiling point: 973.563°C at 760 mmHg (Cal.)
• Flash point: 542.592°C (Cal.)