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CHEBI:59306 - α-D-Kdo-(2→4)-α-D-Kdo-(2→8)-α-D-Kdo-(2→4)-α-D-Kdo

ChEBI IDCHEBI:59306
ChEBI Nameα-D-Kdo-(2→4)-α-D-Kdo-(2→8)-α-D-Kdo-(2→4)-α-D-Kdo
Stars
ASCII Namealpha-D-Kdo-(2->4)-alpha-D-Kdo-(2->8)-alpha-D-Kdo-(2->4)-alpha-D-Kdo
DefinitionA tetrasaccharide consisting of four 3-deoxy-D-manno-oct-2-ulose residues in a linear sequence, joined via α-linkages.
Last Modified19 July 2016
SubmitterSteve
DownloadsMolfile
FormulaC32H50O29
Net Charge0
Average Mass898.723
Monoisotopic Mass898.24378
SMILES[H][C@]1([C@H](O)CO)O[C@@](O[C@@H]2C[C@](OC[C@@H](O)[C@@]3([H])O[C@@](O[C@@H]4C[C@](O)(C(=O)O)O[C@]([H])([C@H](O)CO)[C@@H]4O)(C(=O)O)C[C@@H](O)[C@H]3O)(C(=O)O)O[C@]([H])([C@H](O)CO)[C@@H]2O)(C(=O)O)C[C@@H](O)[C@H]1O
WURCSWURCS=2.0/1,4,3/[Aad1122h-2a_2-6]/1-1-1-1/a4-b2_b8-c2_c4-d2
InChIInChI=1S/C32H50O29/c33-5-11(38)21-17(42)9(36)1-32(60-21,28(52)53)57-16-4-30(26(48)49,59-23(20(16)45)13(40)7-35)55-8-14(41)24-18(43)10(37)2-31(61-24,27(50)51)56-15-3-29(54,25(46)47)58-22(19(15)44)12(39)6-34/h9-24,33-45,54H,1-8H2,(H,46,47)(H,48,49)(H,50,51)(H,52,53)/t9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,29-,30-,31-,32-/m1/s1
InChIKeySKGRFALHFGFSIL-AGBXRWQGSA-N
Roles Classification
Biological Role:
epitope  The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
ChEBI Ontology
Outgoing Relation(s)
α-D-Kdo-(2→4)-α-D-Kdo-(2→8)-α-D-Kdo-(2→4)-α-D-Kdo (CHEBI:59306) has role epitope (CHEBI:53000)
α-D-Kdo-(2→4)-α-D-Kdo-(2→8)-α-D-Kdo-(2→4)-α-D-Kdo (CHEBI:59306) is a tetrasaccharide (CHEBI:50126)
IUPAC Name 
3-deoxy-α-D-manno-oct-2-ulopyranonosyl-(2→4)-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
Kdoα2-4Kdoα2-8Kdoα2-4KdoαChEBI
Citations