Urocanic Acid

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 42
Total Number of Articles : 62
PubChem 736715
Molecular Formula

C6H6N2O2

SMILES

C1=C(NC=N1)/C=C/C(=O)O

InChI

InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/b2-1+

synonyms
  • urocanic acid
  • 4-imidazoleacrylic acid
  • 104-98-3
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Properties
Property Value
MW 138.12 g/mol
HBD 2
HBA 3
Rotatable Bond Count 2
Exact Mass 138.042927438 g/mol
Monoisotopic Mass 138.042927438 g/mol
Heavy Atom Count 10
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 156
xlogp 0
Topological Polar Surface Area 66