4-Guanidinobutyric Acid

4-Guanidinobutyric synonyms

gamma-Guanidinobutyrate; gamma-Guanidinobutyric acid; 4-((amino(imino)methyl)amino)butanoic acid; .gamma.-Guanidinobutyric acid; 4-guanidinobutanoic acid; 4-Guanidinobutanoate; 4-(carbamimidamido)butanoic acid


Graphical representations:


View large 3D structure

Molecular Formula: C5H11N3O2

Natural Isotopic Abundance Mass: 145.15974

Mono-Isotopic Molecular Masses:

  • C12N14: 145.0851266129
  • C13N14: 150.1019008019
  • C12N15: 148.0762312925
  • C13N15: 153.0930054815

InChI string: InChI=1S/C5H11N3O2/c6-5(7)8-3-1-2-4(9)10/h1-3H2,(H,9,10)(H4,6,7,8)

PubChem Compound (CID): 500
CAS Registry number: 463-00-3
Sigma-Aldrich: G6503_SIGMA
ChEBI: CHEBI:15728
ChemSpider: 486
NIST: 2962084244
CambridgeSoft Corporation: 4194
Emory University Molecular Libraries Screening Center: NCI521717
PDSP: nsc521717
KEGG Compound ID: C01035
ChemDB: 6420928

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, https://www.nature.com/articles/sdata201773)