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CHEBI:149302 - N-[(2R,3R,4R,5R,6R)-4,5-Dihydroxy-2-[(2R,3S,4S,5R,6S)-3-hydroxy-2-(hydroxymethyl)-6-[(3R,4S,5R,6R)-2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)oxan-3-yl]acetamide
| Formula | C26H45NO20 |
| Net Charge | 0 |
| Average Mass | 691.633 |
| Monoisotopic Mass | 691.25349 |
| SMILES | CC(=O)N[C@H]1[C@@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](CO)OC(O)[C@@H]3O)[C@@H]2O[C@@H]2O[C@@H](C)[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-1x_1-5][a2112h-1b_1-5][a1221m-1a_1-5][a2112h-1a_1-5_2*NCC/3=O]/1-2-3-4/a3-b1_b2-c1_b3-d1 |
| InChI | InChI=1S/C26H45NO20/c1-6-12(32)17(37)18(38)25(41-6)47-22-21(46-24-11(27-7(2)31)16(36)13(33)8(3-28)43-24)15(35)10(5-30)44-26(22)45-20-14(34)9(4-29)42-23(40)19(20)39/h6,8-26,28-30,32-40H,3-5H2,1-2H3,(H,27,31)/t6-,8+,9+,10+,11+,12+,13-,14+,15-,16+,17+,18-,19+,20-,21-,22+,23?,24+,25-,26-/m0/s1 |
| InChIKey | MOIVXTCTXQHTFY-XKBLIFGRSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2R,3R,4R,5R,6R)-4,5-Dihydroxy-2-[(2R,3S,4S,5R,6S)-3-hydroxy-2-(hydroxymethyl)-6-[(3R,4S,5R,6R)-2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)oxan-3-yl]acetamide (CHEBI:149302) is a oligosaccharide (CHEBI:50699) |
| Synonyms | Source |
|---|---|
| 6-deoxy-alpha-L-galacto-hexopyranosyl-(1->2)-[2-acetamido-2-deoxy-alpha-D-galacto-hexopyranosyl-(1->3)]-beta-D-galacto-hexopyranosyl-(1->3)-D-gluco-hexopyranose | SUBMITTER |
| Fuc(a1-2)[GalNAc(a1-3)]Gal(b1-3)Glc | SUBMITTER |