EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:61571 - α-Kdo-(2→4)-α-Kdo-CH2OH

ChEBI IDCHEBI:61571
ChEBI Nameα-Kdo-(2→4)-α-Kdo-CH2OH
Stars
ASCII Namealpha-Kdo-(2->4)-alpha-Kdo-CH2OH
DefinitionA disaccharide comprising 3-deoxy-α-D-manno-oct-2-ulopyranose (Kdo-CH2OH) having a 3-deoxy-α-D-manno-oct-2-ulopyranonosyl (Kdo) residue attached at the 4-position.
Last Modified30 March 2011
SubmitterSteve
DownloadsMolfile
FormulaC16H28O14
Net Charge0
Average Mass444.386
Monoisotopic Mass444.14791
SMILES[H][C@]1([C@H](O)CO)O[C@@](O[C@@H]2C[C@](O)(CO)O[C@]([H])([C@H](O)CO)[C@@H]2O)(C(=O)O)C[C@@H](O)[C@H]1O
WURCSWURCS=2.0/2,2,1/[had1122h-2a_2-6][Aad1122h-2a_2-6]/1-2/a4-b2
InChIInChI=1S/C16H28O14/c17-3-7(21)12-10(23)6(20)1-16(30-12,14(25)26)28-9-2-15(27,5-19)29-13(11(9)24)8(22)4-18/h6-13,17-24,27H,1-5H2,(H,25,26)/t6-,7-,8-,9-,10-,11-,12-,13-,15-,16-/m1/s1
InChIKeyHTXLJYLECXZCGC-VSHXQWHESA-N
ChEBI Ontology
Outgoing Relation(s)
α-Kdo-(2→4)-α-Kdo-CH2OH (CHEBI:61571) is a disaccharide (CHEBI:36233)
IUPAC Name 
3-deoxy-α-D-manno-oct-2-ulopyranonosyl-(2→4)-3-deoxy-α-D-manno-oct-2-ulopyranose
Synonyms  Source
α-Kdo-(2→4)-α-Kdo-C1redChEBI
α-Kdo-(2→4)-α-Kdo-OHChEBI
3-deoxy-4-O-(3-deoxy-α-D-manno-oct-2-ulopyranonosyl)-α-D-manno-oct-2-ulopyranoseIUPAC
Citations