EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H38O22 |
| Net Charge | 0 |
| Average Mass | 678.546 |
| Monoisotopic Mass | 678.18547 |
| SMILES | [H][C@]1([C@H](O)CO)O[C@@](OC[C@@H](O)[C@@]2([H])O[C@@](O[C@@H]3C[C@](O)(C(=O)O)O[C@]([H])([C@H](O)CO)[C@@H]3O)(C(=O)O)C[C@@H](O)[C@H]2O)(C(=O)O)C[C@@H](O)[C@H]1O |
| WURCS | WURCS=2.0/1,3,2/[Aad1122h-2a_2-6]/1-1-1/a4-b2_b8-c2 |
| InChI | InChI=1S/C24H38O22/c25-4-9(29)16-13(32)7(27)1-23(45-16,20(37)38)42-6-11(31)18-14(33)8(28)2-24(46-18,21(39)40)43-12-3-22(41,19(35)36)44-17(15(12)34)10(30)5-26/h7-18,25-34,41H,1-6H2,(H,35,36)(H,37,38)(H,39,40)/t7-,8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,22-,23-,24-/m1/s1 |
| InChIKey | GWUOCEYDSDYWMC-VGCKMWDQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| α-Kdo-(2→8)-α-Kdo-(2→4)-α-Kdo (CHEBI:59292) is a trisaccharide (CHEBI:27150) |
| IUPAC Name |
|---|
| 3-deoxy-α-D-manno-oct-2-ulopyranonosyl-(2→8)-3-deoxy-α-D-manno-oct-2-ulopyranonosyl-(2→4)-3-deoxy-α-D-manno-oct-2-ulopyranosonic acid |
| Synonym | Source |
|---|---|
| Kdoα2-8Kdoα2-4Kdoα | ChEBI |
| Citations |
|---|