|
Biological Magnetic Resonance Data BankA Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules |
Member of
![]() |
2-Amino-3-phosphonopropanoate; Phosphonoalanine; 2-Amino-3-phosphono-propionic acid; 3-phosphonoalanine
Molecular Formula: C3 H8 N O5 P
Natural Isotopic Abundance Mass: 169.073081
Mono-Isotopic Molecular Masses:
InChI String: InChI=1S/C3H8NO5P/c4-2(3(5)6)1-10(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9)/t2-/m0/s1
canonical and isomeric SMILES: C(C(C(=O)O)N)P(=O)(O)O
PUBCHEM iupac NAME: PUBCHEM iupac CAS NAME
2-amino-3-phosphonopropanoic acid
PUBCHEM iupac TRADITIONAL NAME
2-amino-3-phosphono-propionic acid
PUBCHEM iupac OPENEYE NAME
2-amino-3-phosphono-propanoic acid
PUBCHEM iupac SYSTEMATIC NAME
2-azanyl-3-phosphono-propanoic acid
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
Atom numbering calculated using ALATIS. Citation: 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