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Substance Name: 3-Methylglutarylcarnitine
RN: 102673-95-0
InChIKey: HFCPFJNSBPQJDP-UHFFFAOYSA-N

Note

  • Diagnostic metabolite of 3-hydroxy-3-methylglutaryl-coenzyme A lyase deficiency.

Molecular Formula

  • C13-H23-N-O6

Molecular Weight

  • 289.326
 
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Names and Synonyms

Name of Substance

  • 3-Methylglutarylcarnitine

Synonym

  • 3-Carboxy-2-(4-carboxy-3-methyl-1-oxobutoxy)-N,N,N-trimethyl-1-propanaminium hydroxide, inner salt

Systematic Name

  • 1-Propanaminium, 3-carboxy-2-(4-carboxy-3-methyl-1-oxobutoxy)-N,N,N-trimethyl-, hydroxide, inner salt

Registry Numbers

CAS Registry Number

  • 102673-95-0

System Generated Number

  • 0102673950

Structure Descriptors

InChI

1S/C13H23NO6/c1-9(5-11(15)16)6-13(19)20-10(7-12(17)18)8-14(2,3)4/h9-10H,5-8H2,1-4H3,(H-,15,16,17,18)

InChIKey

HFCPFJNSBPQJDP-UHFFFAOYSA-N

Smiles

C([C@@H](CC(=O)O)OC(C[C@@H](CC(=O)[O-])C)=O)[N+](C)(C)C