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4-Nitrophenyl 2-Acetamido-6-O-(2-acetamido-2-deoxy-Beta-D-glucopyranosyl) -3-O-(Beta-D-galactopyranosyl)-2-deoxy-Alpha-D-galactopyranoside

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For Research Use Only | Not For Clinical Use
CATAPS139459555
CAS139459-55-5
Structure
IUPAC NameN-[(2R,3R,4R,5S,6R)-2-[[(2R,3R,4R,5R,6R)-5-acetamido-3-hydroxy-6-(4-nitrophenoxy)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Molecular Weight707.63
Molecular FormulaC28H41N3O18
Canonical SMILESCC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1OC[C@H]2O[C@H](Oc3ccc(cc3)[N+](=O)[O-])[C@H](NC(=O)C)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]2O
InChIInChI=1S/C28H41N3O18/c1-10(34)29-17-22(39)19(36)14(7-32)46-26(17)44-9-16-21(38)25(49-28-24(41)23(40)20(37)15(8-33)47-28)18(30-11(2)35)27(48-16)45-13-5-3-12(4-6-13)31(42)43/h3-6,14-28,32-33,36-41H,7-9H2,1-2H3,(H,29,34)(H,30,35)/t14-,15-,16-,17-,18-,19-,20+,21+,22-,23+,24-,25-,26-,27+,28+/m1/s1
Accurate Mass707.2385
FormatNeat
SubcategoryOligosaccharides
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