CHEBI:64676 - CDP-N,N-dimethylethanolamine

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ChEBI Name CDP-N,N-dimethylethanolamine
ChEBI ID CHEBI:64676
ChEBI ASCII Name CDP-N,N-dimethylethanolamine
Definition A nucleotide-(amino alcohol) that is the N,N-dimethyl derivative of CDP-ethanolamine.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Paola Roncaglia
Supplier Information
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Formula C13H24N4O11P2
Net Charge 0
Average Mass 474.29740
Monoisotopic Mass 474.09168
InChI InChI=1S/C13H24N4O11P2/c1-16(2)5-6-25-29(21,22)28-30(23,24)26-7-8-10(18)11(19)12(27-8)17-4-3-9(14)15-13(17)20/h3-4,8,10-12,18-19H,5-7H2,1-2H3,(H,21,22)(H,23,24)(H2,14,15,20)/t8-,10-,11-,12-/m1/s1
InChIKey FOYCPAILIPEVBT-HJQYOEGKSA-N
SMILES CN(C)CCOP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(N)nc1=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing CDP-N,N-dimethylethanolamine (CHEBI:64676) has functional parent CDP-ethanolamine (CHEBI:16732)
CDP-N,N-dimethylethanolamine (CHEBI:64676) is a nucleotide-(amino alcohol)s (CHEBI:25604)
CDP-N,N-dimethylethanolamine (CHEBI:64676) is a phosphoethanolamine (CHEBI:36711)
CDP-N,N-dimethylethanolamine (CHEBI:64676) is conjugate acid of CDP-N,N-dimethylethanolamine(1−) (CHEBI:65117)
Incoming CDP-N,N-dimethylethanolamine(1−) (CHEBI:65117) is conjugate base of CDP-N,N-dimethylethanolamine (CHEBI:64676)
IUPAC Name
5'-O-[({[2-(dimethylamino)ethoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]cytidine
Synonym Source
CDP-N-dimethylethanolamine MetaCyc
Manual Xref Database
CPD4FS-1 MetaCyc
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Last Modified
04 July 2012