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CHEBI:150349 - (2S,3S,4R,5R)-3-[(2R,3R,4R,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-(sulfoamino)oxan-2-yl]oxy-4,5,6-trihydroxyoxane-2-carboxylic acid
| Formula | C12H21NO14S |
| Net Charge | 0 |
| Average Mass | 435.360 |
| Monoisotopic Mass | 435.06828 |
| SMILES | O=C(O)[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NS(=O)(=O)O |
| WURCS | WURCS=2.0/2,2,1/[a2122A-1x_1-5][a2122h-1a_1-5_2*NSO/3=O/3=O]/1-2/a4-b1 |
| InChI | InChI=1S/C12H21NO14S/c14-1-2-4(15)5(16)3(13-28(22,23)24)12(25-2)27-8-6(17)7(18)11(21)26-9(8)10(19)20/h2-9,11-18,21H,1H2,(H,19,20)(H,22,23,24)/t2-,3-,4-,5-,6-,7-,8+,9+,11?,12-/m1/s1 |
| InChIKey | OYZYWCGFYZMWQP-KRLUWVLBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2S,3S,4R,5R)-3-[(2R,3R,4R,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-(sulfoamino)oxan-2-yl]oxy-4,5,6-trihydroxyoxane-2-carboxylic acid (CHEBI:150349) is a O-acyl carbohydrate (CHEBI:52782) |
| Synonyms | Source |
|---|---|
| 2-deoxy-2-sulfoamino-alpha-D-gluco-hexopyranosyl-(1->4)-D-gluco-hexopyranuronic acid | SUBMITTER |
| GlcNS(a1-4)GlcA | SUBMITTER |