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CHEBI:148113 - β-D-GlcpNAc-(1→4)-[β-D-Manp-(1→6)]-β-D-GlcpNAc
| Formula | C22H38N2O16 |
| Net Charge | 0 |
| Average Mass | 586.544 |
| Monoisotopic Mass | 586.22213 |
| SMILES | CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)O[C@H]1O |
| WURCS | WURCS=2.0/2,3,2/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5]/1-1-2/a4-b1_a6-c1 |
| InChI | InChI=1S/C22H38N2O16/c1-6(27)23-11-16(32)19(40-21-12(24-7(2)28)15(31)13(29)8(3-25)38-21)10(37-20(11)35)5-36-22-18(34)17(33)14(30)9(4-26)39-22/h8-22,25-26,29-35H,3-5H2,1-2H3,(H,23,27)(H,24,28)/t8-,9-,10-,11-,12-,13-,14-,15-,16-,17+,18+,19-,20-,21+,22-/m1/s1 |
| InChIKey | WPRADGGPMBSMAN-GWHHVMAYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| β-D-GlcpNAc-(1→4)-[β-D-Manp-(1→6)]-β-D-GlcpNAc (CHEBI:148113) has functional parent N-acetyl-β-D-glucosaminyl-(1→4)-N-acetyl-β-D-glucosamine (CHEBI:50670) |
| β-D-GlcpNAc-(1→4)-[β-D-Manp-(1→6)]-β-D-GlcpNAc (CHEBI:148113) is a acetamides (CHEBI:22160) |
| β-D-GlcpNAc-(1→4)-[β-D-Manp-(1→6)]-β-D-GlcpNAc (CHEBI:148113) is a amino trisaccharide (CHEBI:59266) |
| β-D-GlcpNAc-(1→4)-[β-D-Manp-(1→6)]-β-D-GlcpNAc (CHEBI:148113) is a glucosamine oligosaccharide (CHEBI:22485) |
| IUPAC Names |
|---|
| GlcNAc(b1-4)[Man(b1-6)]b-GlcNAc |
| 2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-[β-D-mannopyranosyl-(1→6)]-2-acetamido-2-deoxy-β-D-glucopyranose |
| Synonyms | Source |
|---|---|
| 2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→4)-[β-D-manno-hexopyranosyl-(1→6)]-2-acetamido-2-deoxy-β-D-gluco-hexopyranose | IUPAC |
| N-[(2R,3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamide | IUPAC |