Home Amines 102636-82-8
102636-82-8,MFCD16036250
Catalog No.:AA0007X2
102636-82-8 | 1-Propanaminium, 3-carboxy-2-(4-carboxy-1-oxobutoxy)-N,N,N-trimethyl-, inner salt, (2R)-
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10mg
98.0%
2 weeks  
$193.00   $135.00
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Technical Information
Catalog Number:
AA0007X2
Chemical Name:
1-Propanaminium, 3-carboxy-2-(4-carboxy-1-oxobutoxy)-N,N,N-trimethyl-, inner salt, (2R)-
CAS Number:
102636-82-8
Molecular Formula:
C12H21NO6
Molecular Weight:
275.2982
MDL Number:
MFCD16036250
IUPAC Name:
(3R)-3-(4-carboxybutanoyloxy)-4-(trimethylazaniumyl)butanoate
InChI:
InChI=1S/C12H21NO6/c1-13(2,3)8-9(7-11(16)17)19-12(18)6-4-5-10(14)15/h9H,4-8H2,1-3H3,(H-,14,15,16,17)/t9-/m1/s1
InChI Key:
NXJAXUYOQLTISD-SECBINFHSA-N
SMILES:
O=C(O[C@@H](C[N+](C)(C)C)CC(=O)O)CCCC(=O)[O-]
Properties
Computed Properties
 
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
275.137g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
275.301g/mol
Monoisotopic Mass:
275.137g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  

Synonyms
 
glutarylcarnitine 
Glutarylcarnitine 
(3R)-3-[(4-carboxybutanoyl)oxy]-4-(trimethylammonio)butanoate 
(3R)-3-[(4-Carboxybutanoyl)oxy]-4-(trimethylazaniumyl)butanoate 
(2R)-3-Carboxy-2-(4-carboxy-1-oxobutoxy)-N,N,N-trimethyl-1-propanaminium Inner Salt 
L-Glutaryl Carnitine See G597605 
102636-82-8 
glutaroyl carnitine 
glutaryl-L-carnitine 
L-Glutaryl Carnitine 
O-glutaroyl-L-carnitine 
CHEBI:82952 
DTXSID40747861 
J-000747 
Literature

Title: An improved LC-MS/MS method for the detection of classic and low excretor glutaric acidemia type 1.

Journal: Journal of inherited metabolic disease 20120501

Title: Therapeutic modulation of cerebral L-lysine metabolism in a mouse model for glutaric aciduria type I.

Journal: Brain : a journal of neurology 20110101

Title: Comparison of amino acids and acylcarnitines assay methods used in newborn screening assays by tandem mass spectrometry.

Journal: Clinica chimica acta; international journal of clinical chemistry 20100502

Title: False-positive newborn screening mimicking glutaric aciduria type I in infants with renal insufficiency.

Journal: Journal of inherited metabolic disease 20091201

Title: Enzymatic evaluation of glutaric acidemia type 1 by an in vitro probe assay of acylcarnitine profiling using fibroblasts and electrospray ionization/tandem mass spectrometry (MS/MS).

Journal: Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20090901

Title: Maternal glutaric acidemia, type I identified by newborn screening.

Journal: Molecular genetics and metabolism 20080501

Title: Neonatal screening for glutaric aciduria type I: strategies to proceed.

Journal: Journal of inherited metabolic disease 20060101

Title: Glutaryl-CoA dehydrogenase deficiency and newborn screening: retrospective analysis of a low excretor provides further evidence that some cases may be missed.

Journal: Molecular genetics and metabolism 20051101

Title: The urinary excretion of glutarylcarnitine is an informative tool in the biochemical diagnosis of glutaric acidemia type I.

Journal: Molecular genetics and metabolism 20050201

Title: Genetic and biochemical study in a patient with glutaric acidemia type I.

Journal: Journal of the Formosan Medical Association = Taiwan yi zhi 20040701

Title: Pseudo-glutarylcarnitinaemia in medium-chain acyl-CoA dehydrogenase deficiency detected by tandem mass spectrometry newborn screening.

Journal: Journal of inherited metabolic disease 20040101

Title: Stability of malonylcarnitine and glutarylcarnitine in stored blood spots.

Journal: Journal of inherited metabolic disease 20040101

Title: Glutaryl-CoA dehydrogenase deficiency: region-specific analysis of organic acids and acylcarnitines in post mortem brain predicts vulnerability of the putamen.

Journal: Neuropediatrics 20030601

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