N-[4-[2-[(2R,3S,4S,5R)-6-[(1R)-1,2-Dihydroxyethyl]-3,4-Bis[[(2S,3S,4S,5S)-6-[(1R)-1,2-Dihydroxyethyl]-3,4,5-Trihydroxyoxan-2-Yl]Oxy]-5-Hydroxyoxan-2-Yl]Oxyethyl]Phenyl]-2,2,2-Trifluoroacetamide
[CAS# 142270-34-6]

Identification

• Name: N-[4-[2-[(2R,3S,4S,5R)-6-[(1R)-1,2-Dihydroxyethyl]-3,4-Bis[[(2S,3S,4S,5S)-6-[(1R)-1,2-Dihydroxyethyl]-3,4,5-Trihydroxyoxan-2-Yl]Oxy]-5-Hydroxyoxan-2-Yl]Oxyethyl]Phenyl]-2,2,2-Trifluoroacetamide
• Synonyms: N-[4-[2-[(2R,3S,4S,5R)-6-[(1R)-1,2-Dihydroxyethyl]-3,4-Bis[[(2S,3S,4S,5S)-6-[(1R)-1,2-Dihydroxyethyl]-3,4,5-Trihydroxy-Tetrahydropyran-2-Yl]Oxy]-5-Hydroxy-Tetrahydropyran-2-Yl]Oxyethyl]Phenyl]-2,2,2-Trifluoro-Acetamide; N-[4-[2-[[(2R,3S,4S,5R)-6-[(1R)-1,2-Dihydroxyethyl]-3,4-Bis[[(2S,3S,4S,5S)-6-[(1R)-1,2-Dihydroxyethyl]-3,4,5-Trihydroxy-2-Tetrahydropyranyl]Oxy]-5-Hydroxy-2-Tetrahydropyranyl]Oxy]Ethyl]Phenyl]-2,2,2-Trifluoroacetamide; N-[4-[2-[(2R,3S,4S,5R)-6-[(1R)-1,2-Dihydroxyethyl]-3,4-Bis[[(2S,3S,4S,5S)-6-[(1R)-1,2-Dihydroxyethyl]-3,4,5-Trihydroxy-Oxan-2-Yl]Oxy]-5-Hydroxy-Oxan-2-Yl]Oxyethyl]Phenyl]-2,2,2-Trifluoro-Ethanamide
• Molecular Formula: C₃₁H₄₆F₃NO₂₀
• Molecular Weight: 809.69
• CAS Registry Number: 142270-34-6
• SMILES: [C@@H](C4O[C@@H](O[C@@H]2[C@@H]([C@H](OCCC1=CC=C(NC(C(F)(F)F)=O)C=C1)OC([C@H]2O)[C@H](O)CO)O[C@H]3[C@@H](O)[C@@H](O)[C@H](O)C(O3)[C@H](O)CO)[C@@H](O)[C@@H](O)[C@@H]4O)(O)CO
• InChI: 1S/C31H46F3NO20/c32-31(33,34)30(49)35-11-3-1-10(2-4-11)5-6-50-29-26(55-28-20(47)16(43)18(45)23(52-28)13(40)8-37)25(21(48)24(53-29)14(41)9-38)54-27-19(46)15(42)17(44)22(51-27)12(39)7-36/h1-4,12-29,36-48H,5-9H2,(H,35,49)/t12-,13-,14-,15+,16+,17+,18+,19+,20+,21-,22?,23?,24?,25+,26+,27+,28+,29-/m1/s1
• InChIKey: TXYCCNGCDORROL-LOIWZGSKSA-N

Properties

• Density: 1.724g/cm³ (Cal.)
• Boiling point: 1092.849°C at 760 mmHg (Cal.)
• Flash point: 614.733°C (Cal.)