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]2O[C@@H](O[C@H]3[C@H](O)[C@@H](O)C(O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/3,3,2/[a2122h-1x_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-3/a4-b1_b6-c1 |
| InChI | InChI=1S/C20H35NO16/c1-5(24)21-9-12(27)10(25)6(2-22)35-19(9)33-4-8-11(26)13(28)16(31)20(36-8)37-17-7(3-23)34-18(32)15(30)14(17)29/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 | XUKPSCNNYKSPHN-OQXJRWRESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| β-D-GlcpNAc-(1→6)-β-D-Galp-(1→4)-D-Glcp (CHEBI:148195) has functional parent lactose (CHEBI:17716) |
| β-D-GlcpNAc-(1→6)-β-D-Galp-(1→4)-D-Glcp (CHEBI:148195) has functional parent β-D-GlcpNAc-(1→6)-β-D-Galp (CHEBI:148094) |
| β-D-GlcpNAc-(1→6)-β-D-Galp-(1→4)-D-Glcp (CHEBI:148195) is a acetamides (CHEBI:22160) |
| β-D-GlcpNAc-(1→6)-β-D-Galp-(1→4)-D-Glcp (CHEBI:148195) is a amino trisaccharide (CHEBI:59266) |
| IUPAC Names |
|---|
| GlcNAc(b1-6)Gal(b1-4)Glc |
| 2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl-(1→4)-D-glucopyranose |
| Synonyms | Source |
|---|---|
| 2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→6)-β-D-galacto-hexopyranosyl-(1→4)-D-gluco-hexopyranose | IUPAC |
| N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxan-3-yl]acetamide | IUPAC |