EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H35NO16 |
| Net Charge | 0 |
| Average Mass | 545.491 |
| Monoisotopic Mass | 545.19558 |
| 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](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1O |
| WURCS | WURCS=2.0/2,3,2/[a2112h-1a_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-2/a3-b1_a4-c1 |
| InChI | InChI=1S/C20H35NO16/c1-5(25)21-9-17(37-20-15(31)13(29)11(27)7(3-23)35-20)16(8(4-24)33-18(9)32)36-19-14(30)12(28)10(26)6(2-22)34-19/h6-20,22-24,26-32H,2-4H2,1H3,(H,21,25)/t6-,7-,8-,9-,10+,11+,12+,13+,14-,15-,16+,17-,18+,19+,20+/m1/s1 |
| InChIKey | LYDZFUBFIMTEOS-XMXBRKLXSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3R,4R,5R,6R)-2-Hydroxy-6-(hydroxymethyl)-4,5-bis[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-3-yl]acetamide (CHEBI:155446) is a amino sugar (CHEBI:28963) |
| Synonyms | Source |
|---|---|
| beta-D-galacto-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose | SUBMITTER |
| Gal(b1-3)[Gal(b1-4)]a-GalNAc | SUBMITTER |