N-acetylaspartate

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 195
Total Number of Articles : 362
PubChem 65065
Molecular Formula

C6H9NO5

SMILES

CC(=O)N[C@@H](CC(=O)O)C(=O)O

InChI

InChI=1S/C6H9NO5/c1-3(8)7-4(6(11)12)2-5(9)10/h4H,2H2,1H3,(H,7,8)(H,9,10)(H,11,12)/t4-/m0/s1

synonyms
  • N-Acetyl-L-aspartic acid
  • 997-55-7
  • Acetyl-L-aspartic acid
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Properties
Property Value
MW 175.14 g/mol
HBD 3
HBA 5
Rotatable Bond Count 4
Exact Mass 175.04807239 g/mol
Monoisotopic Mass 175.04807239 g/mol
Heavy Atom Count 12
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 212
xlogp -1.1
Topological Polar Surface Area 104