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CHEBI:31997 - N,N-dimethylethanolamine phosphate

ChEBI IDCHEBI:31997
ChEBI NameN,N-dimethylethanolamine phosphate
Stars
ASCII NameN,N-dimethylethanolamine phosphate
DefinitionThe N,N-dimethyl derivative of ethanolamine phosphate.
Last Modified15 January 2019
DownloadsMolfile
FormulaC4H12NO4P
Net Charge0
Average Mass169.117
Monoisotopic Mass169.05039
SMILESCN(C)CCOP(=O)(O)O
InChIInChI=1S/C4H12NO4P/c1-5(2)3-4-9-10(6,7)8/h3-4H2,1-2H3,(H2,6,7,8)
InChIKeyBLHVJAAEHMLMOI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
N,N-dimethylethanolamine phosphate (CHEBI:31997) has role human metabolite (CHEBI:77746)
N,N-dimethylethanolamine phosphate (CHEBI:31997) is a phosphoethanolamine (CHEBI:36711)
N,N-dimethylethanolamine phosphate (CHEBI:31997) is conjugate acid of N,N-dimethylethanolamine phosphate(1−) (CHEBI:58641)
Incoming Relation(s)
N,N-dimethylethanolamine phosphate(1−) (CHEBI:58641) is conjugate base of N,N-dimethylethanolamine phosphate (CHEBI:31997)
IUPAC Name 
2-(dimethylamino)ethyl dihydrogen phosphate
Synonyms  Source
2-dimethylaminoethyl phosphateChemIDplus
demanyl phosphateChemIDplus
PhosphodimethylethanolamineKEGG COMPOUND
phosphoric acid, mono(2-(dimethylamino)ethyl) esterChemIDplus
Manual XrefsDatabases
C13482KEGG COMPOUND
Registry NumbersSources
Beilstein:1766898Beilstein
CAS:6909-62-2ChemIDplus