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](OC[C@H]2OC(O)[C@H](O)[C@@H](O)[C@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O |
| WURCS | WURCS=2.0/3,3,2/[a2112h-1x_1-5][a2122h-1a_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-3/a6-b1_b4-c1 |
| InChI | InChI=1S/C20H35NO16/c1-5(24)21-9-12(27)17(37-20-16(31)14(29)10(25)6(2-22)35-20)7(3-23)36-19(9)33-4-8-11(26)13(28)15(30)18(32)34-8/h6-20,22-23,25-32H,2-4H2,1H3,(H,21,24)/t6-,7-,8-,9-,10+,11+,12-,13+,14+,15-,16-,17-,18?,19+,20+/m1/s1 |
| InChIKey | VZIJAGXHAXHZJU-IFGLKIMDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| β-D-Galp-(1→4)-α-D-GlcpNAc-(1→6)-D-Galp (CHEBI:146777) has functional parent β-D-Galp-(1→4)-α-D-GlcpNAc (CHEBI:44331) |
| β-D-Galp-(1→4)-α-D-GlcpNAc-(1→6)-D-Galp (CHEBI:146777) is a acetamides (CHEBI:22160) |
| β-D-Galp-(1→4)-α-D-GlcpNAc-(1→6)-D-Galp (CHEBI:146777) is a amino trisaccharide (CHEBI:59266) |
| IUPAC Names |
|---|
| Gal(b1-4)GlcNAc(a1-6)Gal |
| β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-α-D-glucopyranosyl-(1→6)-D-galactopyranose |
| Synonyms | Source |
|---|---|
| β-D-galacto-hexopyranosyl-(1→4)-2-acetamido-2-deoxy-α-D-gluco-hexopyranosyl-(1→6)-D-galacto-hexopyranose | IUPAC |
| N-[(2S,3R,4R,5S,6R)-4-hydroxy-6-(hydroxymethyl)-2-[[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide | IUPAC |