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CHEBI:148339 - β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalNAc-OH
| Formula | C22H40N2O16 |
| Net Charge | 0 |
| Average Mass | 588.560 |
| Monoisotopic Mass | 588.23778 |
| SMILES | CC(=O)N[C@H]1[C@H](OC[C@@H](O)[C@H](O)[C@H](O)[C@H](CO)NC(C)=O)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/[h2112h_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-3/a6-b1_b4-c1 |
| InChI | InChI=1S/C22H40N2O16/c1-7(28)23-9(3-25)14(31)15(32)10(30)6-37-21-13(24-8(2)29)17(34)20(12(5-27)39-21)40-22-19(36)18(35)16(33)11(4-26)38-22/h9-22,25-27,30-36H,3-6H2,1-2H3,(H,23,28)(H,24,29)/t9-,10+,11+,12+,13+,14+,15-,16-,17+,18-,19+,20+,21+,22-/m0/s1 |
| InChIKey | PDNOBVUCOLDECA-CNXJRYOBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalNAc-OH (CHEBI:148339) has functional parent N-acetyl-D-galactosaminitol (CHEBI:53480) |
| β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalNAc-OH (CHEBI:148339) has functional parent N-acetyllactosamine (CHEBI:16153) |
| β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalNAc-OH (CHEBI:148339) is a acetamides (CHEBI:22160) |
| β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalNAc-OH (CHEBI:148339) is a glycoside (CHEBI:24400) |
| β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalNAc-OH (CHEBI:148339) is a glycosyl alditol derivative (CHEBI:63424) |
| IUPAC Name |
|---|
| β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)-2-acetamido-2-deoxy-D-galactitol |
| Synonyms | Source |
|---|---|
| N-[(2R,3R,4R,5S,6R)-2-[(2R,3R,4R,5S)-5-acetamido-2,3,4,6-tetrahydroxyhexoxy]-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide | IUPAC |
| β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)-D-GalNAc-ol | ChEBI |