[2,3,4,5,6-pentakis(fluoranyl)phenyl] (2S)-3-[(2S,3R,4R,5R,6R)-5-acetyloxy-6-(acetyloxymethyl)-3-azido-4-[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate

Systemtic Name: [2,3,4,5,6-pentakis(fluoranyl)phenyl] (2S)-3-[(2S,3R,4R,5R,6R)-5-acetyloxy-6-(acetyloxymethyl)-3-azido-4-[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate Openeye Name: (2,3,4,5,6-pentafluorophenyl) (2S)-3-[(2S,3R,4R,5R,6R)-5-acetoxy-6-(acetoxymethyl)-3-azido-4-[(2R,3R,4S,5S,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate CAS Name: (2S)-3-[[(2S,3R,4R,5R,6R)-5-acetyloxy-6-(acetyloxymethyl)-3-azido-4-[[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]propanoic acid (2,3,4,5,6-pentafluorophenyl) ester IUPAC Name: (2,3,4,5,6-pentafluorophenyl) (2S)-3-[(2S,3R,4R,5R,6R)-5-acetyloxy-6-(acetyloxymethyl)-3-azido-4-[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate Traditional Name: (2S)-3-[(2S,3R,4R,5R,6R)-5-acetoxy-6-(acetoxymethyl)-3-azido-4-[(2R,3R,4S,5S,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid (2,3,4,5,6-pentafluorophenyl) ester Formula: C48H47F5N4O20 MolecularWeight: 1094.893596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OCC(C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)N=[N+]=[N-])OC6C(C(C(C(O6)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OC[C@@H](C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)N=[N+]=[N-])O[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C48H47F5N4O20/c1-19(58)66-17-31-39(70-21(3)60)42(77-47-44(73-24(6)63)43(72-23(5)62)40(71-22(4)61)32(75-47)18-67-20(2)59)38(56-57-54)46(74-31)68-16-30(45(64)76-41-36(52)34(50)33(49)35(51)37(41)53)55-48(65)69-15-29-27-13-9-7-11-25(27)26-12-8-10-14-28(26)29/h7-14,29-32,38-40,42-44,46-47H,15-18H2,1-6H3,(H,55,65)/t30-,31+,32+,38+,39-,40-,42+,43-,44+,46-,47-/m0/s1