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CHEBI:155729 - N-[(2R,3R,4R,5R,6R)-2-[[(2R,3R,4S,5R,6R)-6-[(2R,3R,4R,5R,6S)-4,5-Dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
| Formula | C26H45NO21 |
| Net Charge | 0 |
| Average Mass | 707.632 |
| Monoisotopic Mass | 707.24841 |
| SMILES | CC(=O)N[C@H]1[C@H](OC[C@H]2O[C@H](O[C@@H]3[C@H](O)[C@@H](O)[C@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O)O[C@@H]4CO)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@H]2O)O[C@H](CO)[C@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/4,4,3/[a2122h-1b_1-5][a2112h-1b_1-5][a2112h-1a_1-5][a2112h-1b_1-5_2*NCC/3=O]/1-2-3-4/a4-b1_b4-c1_c6-d1 |
| InChI | InChI=1S/C26H45NO21/c1-6(31)27-11-14(34)12(32)7(2-28)44-24(11)42-5-10-13(33)15(35)19(39)25(46-10)48-22-9(4-30)45-26(20(40)17(22)37)47-21-8(3-29)43-23(41)18(38)16(21)36/h7-26,28-30,32-41H,2-5H2,1H3,(H,27,31)/t7-,8-,9-,10-,11-,12+,13+,14-,15+,16-,17-,18-,19-,20-,21-,22+,23-,24-,25-,26+/m1/s1 |
| InChIKey | UAHCFKUGTWRCFP-CGAUVBCBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2R,3R,4R,5R,6R)-2-[[(2R,3R,4S,5R,6R)-6-[(2R,3R,4R,5R,6S)-4,5-Dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide (CHEBI:155729) is a oligosaccharide (CHEBI:50699) |
| Synonyms | Source |
|---|---|
| 2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->6)-alpha-D-galacto-hexopyranosyl-(1->4)-beta-D-galacto-hexopyranosyl-(1->4)-beta-D-gluco-hexopyranose | SUBMITTER |
| GalNAc(b1-6)Gal(a1-4)Gal(b1-4)b-Glc | SUBMITTER |