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CHEBI:147618 - β-D-Galp-(1→3)-β-D-GlcpNAc-(1→3)-α-D-GalpNAc
| 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]2O[C@H](CO)[C@@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2NC(C)=O)[C@@H](O)[C@@H](CO)O[C@@H]1O |
| WURCS | WURCS=2.0/3,3,2/[a2112h-1a_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-3/a3-b1_b3-c1 |
| InChI | InChI=1S/C22H38N2O16/c1-6(28)23-11-18(14(31)9(4-26)36-20(11)35)39-21-12(24-7(2)29)19(15(32)10(5-27)37-21)40-22-17(34)16(33)13(30)8(3-25)38-22/h8-22,25-27,30-35H,3-5H2,1-2H3,(H,23,28)(H,24,29)/t8-,9-,10-,11-,12-,13+,14+,15-,16+,17-,18-,19-,20+,21+,22+/m1/s1 |
| InChIKey | CATLUVBGMBLUIJ-CLCYAJKZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| β-D-Galp-(1→3)-β-D-GlcpNAc-(1→3)-α-D-GalpNAc (CHEBI:147618) has functional parent β-D-Galp-(1→3)-β-D-GlcpNAc (CHEBI:61246) |
| β-D-Galp-(1→3)-β-D-GlcpNAc-(1→3)-α-D-GalpNAc (CHEBI:147618) has functional parent β-D-GlcpNAc-(1→3)-α-D-GalpNAc (CHEBI:71344) |
| β-D-Galp-(1→3)-β-D-GlcpNAc-(1→3)-α-D-GalpNAc (CHEBI:147618) is a acetamides (CHEBI:22160) |
| β-D-Galp-(1→3)-β-D-GlcpNAc-(1→3)-α-D-GalpNAc (CHEBI:147618) is a amino trisaccharide (CHEBI:59266) |
| IUPAC Name |
|---|
| β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-2-acetamido-2-deoxy-α-D-galactopyranose |
| Synonyms | Source |
|---|---|
| Gal(b1-3)GlcNAc(b1-3)a-GalNAc | GlyTouCan |
| β-D-galacto-hexopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→3)-2-acetamido-2-deoxy-α-D-galacto-hexopyranose | IUPAC |
| N-[(2S,3R,4R,5R,6R)-4-[(2R,3R,4R,5S,6R)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide | IUPAC |
| Galb1-3GlcNAcb1-3GalNAca | ChEBI |
| β-D-Gal-(1→3)-β-D-GlcNAc-(1→3)-α-D-GalNAc | ChEBI |
| Galβ1-3GlcNAcβ1-3GalNAcα | ChEBI |
| Citations |
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