CHEBI:57823 - 4-CDP-2-C-methyl-D-erythritol(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-CDP-2-C-methyl-D-erythritol(2−)
ChEBI ID CHEBI:57823
ChEBI ASCII Name 4-CDP-2-C-methyl-D-erythritol(2-)
Definition Dianion of 4-CDP-2-C-methyl-D-erythritol arising from deprotonation of the diphosphate OH groups; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C14H23N3O14P2
Net Charge -2
Average Mass 519.29160
Monoisotopic Mass 519.066
InChI InChI=1S/C14H25N3O14P2/c1-14(23,6-18)8(19)5-29-33(26,27)31-32(24,25)28-4-7-10(20)11(21)12(30-7)17-3-2-9(15)16-13(17)22/h2-3,7-8,10-12,18-21,23H,4-6H2,1H3,(H,24,25)(H,26,27)(H2,15,16,22)/p-2/t7-,8-,10-,11-,12-,14+/m1/s1
InChIKey YFAUKWZNPVBCFF-XHIBXCGHSA-L
SMILES C[C@](O)(CO)[C@H](O)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(N)nc1=O
ChEBI Ontology
Outgoing 4-CDP-2-C-methyl-D-erythritol(2−) (CHEBI:57823) is a nucleotide-sugar oxoanion (CHEBI:59737)
4-CDP-2-C-methyl-D-erythritol(2−) (CHEBI:57823) is conjugate base of 4-CDP-2-C-methyl-D-erythritol (CHEBI:16578)
Incoming 4-CDP-2-C-methyl-D-erythritol (CHEBI:16578) is conjugate acid of 4-CDP-2-C-methyl-D-erythritol(2−) (CHEBI:57823)
IUPAC Name
cytidine 5'-{3-[(2R,3S)-2,3,4-trihydroxy-3-methylbutyl] diphosphate}
Synonyms Sources
4-CDP-2-C-methyl-D-erythritol UniProt
4-CDP-2-C-methyl-D-erythritol dianion ChEBI
5'-O-{[({[(2R,3S)-2,3,4-trihydroxy-3-methylbutyl]oxy}phosphinato)oxy]phosphinato}cytidine ChEBI
Registry Number Type Source
9372838 Beilstein Registry Number Beilstein
Last Modified
28 April 2015