EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H26O17 |
| Net Charge | 0 |
| Average Mass | 502.378 |
| Monoisotopic Mass | 502.11700 |
| SMILES | O=C(O)[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O[C@@H]3[C@@H](O)[C@H](O)O[C@H](C(=O)O)[C@H]3O)OC[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/2,3,2/[a2122A-1b_1-5][a212h-1a_1-5]/1-2-1/a3-b1_b3-c1 |
| InChI | InChI=1S/C17H26O17/c18-2-1-30-16(33-10-6(22)12(14(27)28)31-15(29)7(10)23)8(24)9(2)32-17-5(21)3(19)4(20)11(34-17)13(25)26/h2-12,15-24,29H,1H2,(H,25,26)(H,27,28)/t2-,3+,4+,5-,6+,7-,8-,9+,10+,11+,12+,15-,16-,17-/m1/s1 |
| InChIKey | KNMXYLIPJWSRAE-LMPZGDCASA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| β-D-GlcA-(1→3)-α-D-Xyl-(1→3)-β-D-GlcA (CHEBI:91125) is a carbohydrate acid (CHEBI:33720) |
| β-D-GlcA-(1→3)-α-D-Xyl-(1→3)-β-D-GlcA (CHEBI:91125) is a trisaccharide (CHEBI:27150) |
| IUPAC Name |
|---|
| β-D-glucopyranuronosyl-(1→3)-α-D-xylopyranosyl-(1→3)-β-D-glucopyranuronic acid |
| Synonyms | Source |
|---|---|
| GlcA-Xyl-GlcA | ChEBI |
| β-D-GlcpA-(1→3)-α-D-Xylp-(1→3)-β-D-GlcpA | ChEBI |
| β-D-glucuronosyl-(1→3)-α-D-xylosyl-(1→3)-β-D-glucuronic acid | ChEBI |