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[2-(trimethylamino)ethyl]phosphonate

PropertiesImage
MNX_IDMNXM6076 Image of MNXM6076
referencechebi:149625
formulaC5H14NO3P
global charge0
mol weight167.145
InChIKeyVCANKBLUHKRQLL-UHFFFAOYSA-N
InChIInChI=1S/C5H14NO3P/c1-6(2,3)4-5-10(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)
SMILESC[N+](C)(C)CCP(=O)([O-])O
MNX internals
InChI (mnx)InChI=1/C5H14NO3P/c1-6(2,3)4-5-10(7,8)9/h4-5H2,1-3H3,(H-,7,8,9) Image of MNXM6076
SMILES (mnx)[CH3:1][N+:6]([CH3:2])([CH3:3])[CH2:4][CH2:5][P:10]([OH:7])([O-:8])=[O:9]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:149625
chebi:149625
VCANKBLUHKRQLL-UHFFFAOYSA-N 		[2-(trimethylamino)ethyl]phosphonate
[2-(trimethylamino)ethyl]phosphonate zwitterion

seed.compound:cpd03876
seedM:cpd03876
VCANKBLUHKRQLL-UHFFFAOYSA-N 		2-Trimethylaminoethylphosphonate
N-Trimethyl-2-aminoethylphosphonate

CHEBI:7347
chebi:7347
VCANKBLUHKRQLL-UHFFFAOYSA-O 		2-trimethylaminoethylphosphonic acid
N,N,N-trimethyl-2-aminoethylphosphonic acid
N,N,N-trimethyl-2-phosphonoethanaminium

bigg.metabolite:ntm2amep
biggM:ntm2amep
VCANKBLUHKRQLL-UHFFFAOYSA-M 		N-Trimethyl-2-aminoethylphosphonate

kegg.compound:C06459
keggC:C06459
VCANKBLUHKRQLL-UHFFFAOYSA-O 		N-Trimethyl-2-aminoethylphosphonate
2-Trimethylaminoethylphosphonate

vmhM:ntm2amep
vmhmetabolite:ntm2amep
VCANKBLUHKRQLL-UHFFFAOYSA-M 		N-Trimethyl-2-aminoethylphosphonate
4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol

metacyc.compound:CPD-22922
metacycM:CPD-22922
VCANKBLUHKRQLL-UHFFFAOYSA-N 		[(2-trimethyl)aminoethyl]phosphonate
N,N,N-trimethyl-2-phosphonoethanaminium
TMAEP
[(2-trimethyl)aminoethyl]phosphonic acid

kegg.compound:C22281
keggC:C22281
VCANKBLUHKRQLL-UHFFFAOYSA-N 		[2-(Trimethylamino)ethyl]phosphonate

biggM:M_ntm2amep
keggC:M_C06459
keggC:M_C22281
seedM:M_cpd03876
vmhM:M_ntm2amep 		secondary/obsolete/fantasy identifier