Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

2-amino-3-(3H-imidazol-4-yl)propanoic Acid

2-amino-3-(3H-imidazol-4-yl)propanoic Acid synonyms



Graphical representations:


View large 3D structure

Molecular Formula: C6H9N3O2

Natural Isotopic Abundance Mass: 155.15456

Mono-Isotopic Molecular Masses:

  • C12N14: 155.069476543
  • C13N14: 161.089605571
  • C12N15: 158.060581222
  • C13N15: 164.08071025

InChI string: InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m1/s1

MMCD: cq_03617
PubChem Compound (CID): 71083

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73,