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CHEBI:58166 - CDP-4-dehydro-6-deoxy-D-glucose(2−)

ChEBI IDCHEBI:58166
ChEBI NameCDP-4-dehydro-6-deoxy-D-glucose(2−)
Stars
ASCII NameCDP-4-dehydro-6-deoxy-D-glucose(2-)
DefinitionDianion of CDP-4-dehydro-6-deoxy-D-glucose arising from deprotonation of the diphosphate OH groups; major species at pH 7.3.
Last Modified30 June 2014
DownloadsMolfile
FormulaC15H21N3O15P2
Net Charge-2
Average Mass545.287
Monoisotopic Mass545.04589
SMILESC[C@H]1OC(OP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H](n3ccc(N)nc3=O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)C1=O
InChIInChI=1S/C15H23N3O15P2/c1-5-8(19)10(21)12(23)14(30-5)32-35(27,28)33-34(25,26)29-4-6-9(20)11(22)13(31-6)18-3-2-7(16)17-15(18)24/h2-3,5-6,9-14,20-23H,4H2,1H3,(H,25,26)(H,27,28)(H2,16,17,24)/p-2/t5-,6-,9-,10+,11-,12-,13-,14?/m1/s1
InChIKeyPUBYMNIINUUJLL-JOCQNMFKSA-L
ChEBI Ontology
Outgoing Relation(s)
CDP-4-dehydro-6-deoxy-D-glucose(2−) (CHEBI:58166) is a nucleotide-sugar oxoanion (CHEBI:59737)
CDP-4-dehydro-6-deoxy-D-glucose(2−) (CHEBI:58166) is conjugate base of CDP-4-dehydro-6-deoxy-D-glucose (CHEBI:17494)
Incoming Relation(s)
CDP-4-dehydro-6-deoxy-α-D-glucose(2−) (CHEBI:138808) is a CDP-4-dehydro-6-deoxy-D-glucose(2−) (CHEBI:58166)
CDP-4-dehydro-6-deoxy-D-glucose (CHEBI:17494) is conjugate acid of CDP-4-dehydro-6-deoxy-D-glucose(2−) (CHEBI:58166)
IUPAC Name 
cytidine 5'-[3-(6-deoxy-D-xylo-hexopyranosyl-4-ulose) diphosphate]
Synonym  Source
CDP-4-dehydro-6-deoxy-D-glucose dianionChEBI
UniProt Name  Source
CDP-4-dehydro-6-deoxy-D-glucoseUniProt