Pyridoxamine

Pyridoxamine bmse000130 - Data

Pyridoxamine synonyms

PYRIDOXAMINE; 3-Pyridinemethanol, 4-(aminomethyl)-5-hydroxy-6-methyl-; PM

Wikipedia:

Graphical representations:

pyridoxamine

View large 3D structure

Molecular Formula: C8H12N2O2

Natural Isotopic Abundance Mass: 168.1930800000

Mono-Isotopic Molecular Masses:

  • C12N14: 168.08987764
  • C13N14: 176.116716342
  • C12N15: 170.083947426
  • C13N15: 178.1107861286

InChI string: InChI=1S/C8H12N2O2/c1-5-8(12)7(2-9)6(4-11)3-10-5/h3,11-12H,2,4,9H2,1H3

IUPAC: 4-(aminomethyl)-5-(hydroxymethyl)-2-methyl-pyridin-3-ol

PubChem Compound (CID): 1052
KEGG Compound ID: C00534
CAS Registry number: 85-87-0
ChEBI: 16410
EINECS: 201-640-5
PDB Compound ID: PXM

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)