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CHEBI:153652 - N-[(3R,4R,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3-Acetamido-6-[[(2R,3R,4R,5S,6R)-3-acetamido-6-[[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxymethyl]-2,4,5-trihydroxyoxan-3-yl]acetamide
| Formula | C32H54N4O21 |
| Net Charge | 0 |
| Average Mass | 830.791 |
| Monoisotopic Mass | 830.32805 |
| SMILES | CC(=O)N[C@H]1[C@H](OC[C@H]2O[C@@H](OC[C@H]3O[C@@H](OC[C@H]4OC(O)[C@H](NC(C)=O)[C@@H](O)[C@@H]4O)[C@H](NC(C)=O)[C@@H](O)[C@@H]3O)[C@H](NC(C)=O)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/2,4,3/[a2122h-1x_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O]/1-2-2-2/a6-b1_b6-c1_c6-d1 |
| InChI | InChI=1S/C32H54N4O21/c1-9(38)33-17-25(46)22(43)14(54-29(17)50)6-51-31-19(35-11(3)40)27(48)24(45)16(56-31)8-53-32-20(36-12(4)41)28(49)23(44)15(57-32)7-52-30-18(34-10(2)39)26(47)21(42)13(5-37)55-30/h13-32,37,42-50H,5-8H2,1-4H3,(H,33,38)(H,34,39)(H,35,40)(H,36,41)/t13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29?,30-,31-,32-/m1/s1 |
| InChIKey | JTJOEQHJZZBZEP-AXMHGKOQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(3R,4R,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3-Acetamido-6-[[(2R,3R,4R,5S,6R)-3-acetamido-6-[[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxymethyl]-2,4,5-trihydroxyoxan-3-yl]acetamide (CHEBI:153652) is a amino sugar (CHEBI:28963) |
| Synonyms | Source |
|---|---|
| 2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)-2-acetamido-2-deoxy-D-gluco-hexopyranose | SUBMITTER |
| GlcNAc(b1-6)GlcNAc(b1-6)GlcNAc(b1-6)GlcNAc | SUBMITTER |