N-acetylgalactosaminuronic acid

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 387
Total Number of Articles : 592
PubChem 134107
Molecular Formula

C8H13NO7

SMILES

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

InChI

InChI=1S/C8H13NO7/c1-3(11)9-4(2-10)5(12)6(13)7(14)8(15)16/h2,4-7,12-14H,1H3,(H,9,11)(H,15,16)/t4-,5+,6+,7-/m1/s1

synonyms
  • 82838-35-5
  • 2-(Acetylamino)-2-deoxy-L-galacturonic acid
  • (2R,3S,4S,5S)-5-acetamido-2,3,4-trihydroxy-6-oxohexanoic acid
Click to show/hide the synonyms
Properties
Property Value
MW 235.19 g/mol
HBD 5
HBA 7
Rotatable Bond Count 6
Exact Mass 235.06920175 g/mol
Monoisotopic Mass 235.06920175 g/mol
Heavy Atom Count 16
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 280
xlogp -2.6
Topological Polar Surface Area 144