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]1C(O)O[C@H](CO[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/2,3,2/[a2122h-1x_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-2/a6-b1_b6-c1 |
| InChI | InChI=1S/C20H35NO16/c1-5(23)21-9-13(27)11(25)7(35-18(9)32)3-33-20-17(31)15(29)12(26)8(37-20)4-34-19-16(30)14(28)10(24)6(2-22)36-19/h6-20,22,24-32H,2-4H2,1H3,(H,21,23)/t6-,7-,8-,9-,10+,11-,12+,13-,14+,15+,16-,17-,18?,19-,20-/m1/s1 |
| InChIKey | DOTQRWNRHKNWIL-JRRFOYRKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| β-D-Galp-(1→6)-β-D-Galp-(1→6)-D-GlcpNAc (CHEBI:146591) has functional parent β-(1→6)-galactobiose (CHEBI:61770) |
| β-D-Galp-(1→6)-β-D-Galp-(1→6)-D-GlcpNAc (CHEBI:146591) has functional parent β-D-Galp-(1→6)-D-GlcNAcp (CHEBI:62658) |
| β-D-Galp-(1→6)-β-D-Galp-(1→6)-D-GlcpNAc (CHEBI:146591) is a acetamides (CHEBI:22160) |
| β-D-Galp-(1→6)-β-D-Galp-(1→6)-D-GlcpNAc (CHEBI:146591) is a amino trisaccharide (CHEBI:59266) |
| IUPAC Names |
|---|
| Gal(b1-6)Gal(b1-6)GlcNAc |
| β-D-galactopyranosyl-(1→6)-β-D-galactopyranosyl-(1→6)-2-acetamido-2-deoxy-D-glucopyranose |
| Synonyms | Source |
|---|---|
| β-D-galacto-hexopyranosyl-(1→6)-β-D-galacto-hexopyranosyl-(1→6)-2-acetamido-2-deoxy-D-gluco-hexopyranose | IUPAC |
| N-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-3-yl]acetamide | IUPAC |