CHEBI:90525 - 4-O-(2-acetamido-2-deoxy-β-D-glucopyranosyl)-5-O-phosphono-D-ribitol

ChEBI IDCHEBI:90525
ChEBI Name4-O-(2-acetamido-2-deoxy-β-D-glucopyranosyl)-5-O-phosphono-D-ribitol
Stars
ASCII Name4-O-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-5-O-phosphono-D-ribitol
DefinitionA disaccharide phosphate consisting of 2-O-(N-acetyl-β-D-glucosaminyl)ribitol phosphorylated at O-1 of the ribitol residue; a ligand epitope of Staphylococcus aureus.
Last Modified27 November 2015
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC13H26NO13P
Net Charge0
Average Mass435.319
Monoisotopic Mass435.11418
SMILESCC(=O)N[C@H]1[C@H](O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H](O)CO)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C13H26NO13P/c1-5(17)14-9-12(21)11(20)7(3-16)26-13(9)27-8(4-25-28(22,23)24)10(19)6(18)2-15/h6-13,15-16,18-21H,2-4H2,1H3,(H,14,17)(H2,22,23,24)/t6-,7+,8+,9+,10-,11+,12+,13-/m0/s1
InChIKeyVRKCYAMLHZHZPR-BXGOZMQFSA-N
Species of MetaboliteComponentSourceComments
Staphylococcus aureus (ncbitaxon:1280) - PubMed (26536114)
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)
4-O-(2-acetamido-2-deoxy-β-D-glucopyranosyl)-5-O-phosphono-D-ribitol (CHEBI:90525) has functional parent 4-O-(2-acetamido-2-deoxy-β-D-glucopyranosyl)-D-ribitol (CHEBI:90583)
4-O-(2-acetamido-2-deoxy-β-D-glucopyranosyl)-5-O-phosphono-D-ribitol (CHEBI:90525) has role epitope (CHEBI:53000)
4-O-(2-acetamido-2-deoxy-β-D-glucopyranosyl)-5-O-phosphono-D-ribitol (CHEBI:90525) is a disaccharide phosphate (CHEBI:23843)
IUPAC Name 
4-O-(2-acetamido-2-deoxy-β-D-glucopyranosyl)-5-O-phosphono-D-ribitol
Synonyms  Source
2-O-(N-acetyl-β-D-glucosaminyl)ribitol 1-phosphateChEBI
4-O-[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl]-5-O-phosphono-D-ribitolPDBeChem
β-D-GlcNAc-(1→4)-D-Rib5P-olChEBI
β-D-GlcpNAc-(1→4)-D-Rib5P-olJCBN
Manual XrefsDatabases
57SPDBeChem
Citations