EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H35NO16 |
| Net Charge | 0 |
| Average Mass | 545.491 |
| Monoisotopic Mass | 545.19558 |
| SMILES | CC(=O)N[C@H]1[C@H](O[C@@H]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O |
| WURCS | WURCS=2.0/3,3,2/[a1122h-1x_1-5][a2122h-1b_1-5_2*NCC/3=O][a2112h-1a_1-5]/1-2-3/a2-b1_b3-c1 |
| InChI | InChI=1S/C20H35NO16/c1-5(25)21-9-16(36-20-15(31)13(29)10(26)7(3-23)35-20)12(28)8(4-24)34-19(9)37-17-14(30)11(27)6(2-22)33-18(17)32/h6-20,22-24,26-32H,2-4H2,1H3,(H,21,25)/t6-,7-,8-,9-,10+,11-,12-,13+,14+,15-,16-,17+,18?,19+,20-/m1/s1 |
| InChIKey | IUOQSNPSYJPUAU-MDQMWMRESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| α-D-Galp-(1→3)-β-D-GlcpNAc-(1→2)-D-Manp (CHEBI:147733) has functional parent α-D-Galp-(1→3)-β-D-GlcpNAc (CHEBI:147845) |
| α-D-Galp-(1→3)-β-D-GlcpNAc-(1→2)-D-Manp (CHEBI:147733) is a acetamides (CHEBI:22160) |
| α-D-Galp-(1→3)-β-D-GlcpNAc-(1→2)-D-Manp (CHEBI:147733) is a amino trisaccharide (CHEBI:59266) |
| Incoming Relation(s) |
| β-D-Galp-(1→3)-β-D-GlcpNAc-(1→2)-α-D-Manp (CHEBI:170004) is a α-D-Galp-(1→3)-β-D-GlcpNAc-(1→2)-D-Manp (CHEBI:147733) |
| IUPAC Names |
|---|
| Gal(a1-3)GlcNAc(b1-2)Man |
| α-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-D-mannopyranose |
| Synonyms | Source |
|---|---|
| α-D-galacto-hexopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→2)-D-manno-hexopyranose | IUPAC |
| N-[(2S,3R,4R,5S,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[(3S,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]acetamide | IUPAC |