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PMG Aspergillus nidulans metabolite library v.01 (Last update 05/10/17)

Showing iCard for L-Leucine (2TMS) (PMG000004)

 

 

 

 

Mass spectrum

(Rel abundance vs m/z)

L-Leucine

Peaks

( 59   21) ( 73  278) ( 74   29) ( 75   44) (100   33)

(102   32) (147   82) (158 1000) (159  135) (160   41)

(218   45) (232   55)

Average Retention time (min)

 

15.51

 

Quant mass (Da)

 

158

 

 

 

 

 

Common Name

L-Leucine

Structure

 

 

Synonym(s)

 

2-Amino-4-methylvaleric acid; (2S)-alpha-2-Amino-4-methylvaleric acid; (2S)-alpha-Leucine

 

KEGG ID

 

C00123

 

Golm Metabolome Database ID

 

A129002

 

PubChem CID

 

3423

 

CAS Registry Number

 

61-90-5

 

Biosynthetic pathways (KEGG)

map00280Valine, leucine and isoleucine degradation map00290Valine, leucine and isoleucine biosynthesis map00966;Glucosinolate biosynthesis map00970Aminoacyl-tRNA biosynthesis map01065Biosynthesis of alkaloids derived from histidine and purine map012102-Oxocarboxylic acid metabolism map01230Biosynthesis of amino acids map02010ABC transporters

Monoisotopic mass (Da)

 

131.0946

 

Average Molecular Mass (Da)

 

131.1729

 

Molecular Formula

 

C6H13NO2

 

Chemical Group

 

Amino acids

 

 

Analyzer

 

Agilent 6890 MS platform; 5973 series mass selective detector (MSD); 7683 autosampler

 

Carrier gas

Helium

Flow rate

 

1 mL min-1

 

Column

 

HP-5MS, length; 30 m, i.d.; 0.25 mm, film thickness 0.25 μm, Agilent Technologies Inc.

 

Ionization

 

Electron Impact (EI), Positive

 

Mass range

 

50-800 Da

 

Injector

 

10:1 split mode; temperature of 230oC

 

Oven temperature

 

70oC stable 5 min; 5oC min-1 increase to 295oC;

stable 2 min

 

 

Curator(s): I. KALAMPOKIS, Dr KA ALIFERIS