office (+30) 210-529-4541
fax (+30) 210-529-4514

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

Showing iCard for Aspartic acid (3TMS) (PMG000017)

 

 

 

 

Mass spectrum

(Rel abundance vs m/z)

Aspartic acid

Peaks

( 73  464) ( 74   51) ( 75   79) (100  144) (147  102)

(188   47) (202   75) (218  192) (219   39) (232 1000)

(233  206) (234   81)

Average Retention time (min)

 

22.17

 

Quant mass (Da)

 

232

 

 

 

 

 

Common Name

 

Aspartic acid

 

Structure

 

Aspartic acid

 

Synonym(s)

 

 

 

 

KEGG ID

 

C00049

 

Golm Metabolome Database ID

 

A152002

 

PubChem CID

 

3351

 

CAS Registry Number

 

56-84-8

 

Biosynthetic pathways (KEGG)

 

map00220Arginine biosynthesis map00250Alanine, aspartate and glutamate metabolism map00260Glycine, serine and threonine metabolism map00270Cysteine and methionine metabolism map00300Lysine biosynthesis map00340Histidine metabolism map00410beta-Alanine metabolism map00460Cyanoamino acid metabolism map00760Nicotinate and nicotinamide metabolism map00770Pantothenate and CoA biosynthesis map00970Aminoacyl-tRNA biosynthesis map01064Biosynthesis of alkaloids derived from ornithine, lysine and nicotinic acid map012102-Oxocarboxylic acid metabolism map01230Biosynthesis of amino acids map02010ABC transporters

 

Monoisotopic mass (Da)

 

133.0375

 

Average Molecular Mass (Da)

 

133.1027

 

Molecular Formula

 

C4H7NO4

 

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