EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H25NO11 |
| Net Charge | 0 |
| Average Mass | 383.350 |
| Monoisotopic Mass | 383.14276 |
| SMILES | CC(=O)N[C@H]1[C@H](OC[C@H]2OC(O)[C@H](O)[C@@H](O)[C@H]2O)O[C@H](CO)[C@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/2,2,1/[a2112h-1x_1-5][a2112h-1b_1-5_2*NCC/3=O]/1-2/a6-b1 |
| InChI | InChI=1S/C14H25NO11/c1-4(17)15-7-10(20)8(18)5(2-16)26-14(7)24-3-6-9(19)11(21)12(22)13(23)25-6/h5-14,16,18-23H,2-3H2,1H3,(H,15,17)/t5-,6-,7-,8+,9+,10-,11+,12-,13?,14-/m1/s1 |
| InChIKey | DTUIBOJYJDJTLH-UUHITYSKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| β-D-GalpNAc-(1→6)-D-Galp (CHEBI:150781) has functional parent N-acetyl-β-D-galactosamine (CHEBI:28497) |
| β-D-GalpNAc-(1→6)-D-Galp (CHEBI:150781) has functional parent D-galactopyranose (CHEBI:4139) |
| β-D-GalpNAc-(1→6)-D-Galp (CHEBI:150781) is a acetamides (CHEBI:22160) |
| β-D-GalpNAc-(1→6)-D-Galp (CHEBI:150781) is a amino disaccharide (CHEBI:22480) |
| IUPAC Names |
|---|
| GalNAc(b1-6)Gal |
| 6-O-(2-acetamido-2-deoxy-β-D-galactopyranosyl)-D-galactopyranose |
| Synonyms | Source |
|---|---|
| 2-acetamido-2-deoxy-β-D-galacto-hexopyranosyl-(1→6)-D-galacto-hexopyranose | IUPAC |
| N-[(2R,3R,4R,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-3-yl]acetamide | IUPAC |