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CHEBI:57876 - CDP-ethanolamine(1−)

ChEBI IDCHEBI:57876
ChEBI NameCDP-ethanolamine(1−)
Stars
ASCII NameCDP-ethanolamine(1-)
DefinitionConjugate base of CDP-ethanolamine arising from deprotonation of the phosphate OH groups and protonation of the amino group; major species at pH 7.3.
Last Modified21 January 2016
DownloadsMolfile
FormulaC11H19N4O11P2
Net Charge-1
Average Mass445.238
Monoisotopic Mass445.05310
SMILESNc1ccn([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OCC[NH3+])[C@@H](O)[C@H]2O)c(=O)n1
InChIInChI=1S/C11H20N4O11P2/c12-2-4-23-27(19,20)26-28(21,22)24-5-6-8(16)9(17)10(25-6)15-3-1-7(13)14-11(15)18/h1,3,6,8-10,16-17H,2,4-5,12H2,(H,19,20)(H,21,22)(H2,13,14,18)/p-1/t6-,8-,9-,10-/m1/s1
InChIKeyWVIMUEUQJFPNDK-PEBGCTIMSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
CDP-ethanolamine(1−) (CHEBI:57876) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
CDP-ethanolamine(1−) (CHEBI:57876) has role human metabolite (CHEBI:77746)
CDP-ethanolamine(1−) (CHEBI:57876) is a organophosphate oxoanion (CHEBI:58945)
CDP-ethanolamine(1−) (CHEBI:57876) is conjugate base of CDP-ethanolamine (CHEBI:16732)
Incoming Relation(s)
CDP-ethanolamine (CHEBI:16732) is conjugate acid of CDP-ethanolamine(1−) (CHEBI:57876)
IUPAC Name 
5'-O-({[(2-ammonioethoxy)phosphinato]oxy}phosphinato)cytidine
Synonym  Source
CDP-ethanolamine cationChEBI
UniProt Name  Source
CDP-ethanolamineUniProt