EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H35NO14 |
| Net Charge | 0 |
| Average Mass | 513.493 |
| Monoisotopic Mass | 513.20575 |
| SMILES | CC(=O)N[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O[C@@H]2O[C@@H](C)C[C@@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O |
| WURCS | WURCS=2.0/3,3,2/[a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][a12d1m-1a_1-5]/1-2-3/a3-b1_a4-c1 |
| InChI | InChI=1S/C20H35NO14/c1-6-3-8(25)12(26)19(31-6)34-16-10(5-23)32-18(30)11(21-7(2)24)17(16)35-20-15(29)14(28)13(27)9(4-22)33-20/h6,8-20,22-23,25-30H,3-5H2,1-2H3,(H,21,24)/t6-,8+,9+,10+,11+,12-,13-,14-,15+,16+,17+,18+,19-,20-/m0/s1 |
| InChIKey | IXNDNNJRSAPNEJ-BIWAGBQZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)-[β-D-Galp-(1→3)]-β-D-GlcpNAc (CHEBI:149135) has functional parent β-D-Galp-(1→3)-β-D-GlcpNAc (CHEBI:61246) |
| 4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)-[β-D-Galp-(1→3)]-β-D-GlcpNAc (CHEBI:149135) is a acetamides (CHEBI:22160) |
| 4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)-[β-D-Galp-(1→3)]-β-D-GlcpNAc (CHEBI:149135) is a amino trisaccharide (CHEBI:59266) |
| IUPAC Names |
|---|
| Gal(b1-3)[4,6-deoxy-L-xylHex(a1-4)]b-GlcNAc |
| 4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)-[β-D-galactopyranosyl-(1→3)]-2-acetamido-2-deoxy-β-D-glucopyranose |
| Synonyms | Source |
|---|---|
| β-D-galacto-hexopyranosyl-(1→3)-[4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)]-2-acetamido-2-deoxy-β-D-gluco-hexopyranose | IUPAC |
| N-[(2R,3R,4R,5S,6R)-5-[(2S,3S,4R,6S)-3,4-dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide | IUPAC |