Phosphoenolpyruvic Acid

Phosphoenolpyruvic Acid bmse000107 - Data bmst000332 - Theory

Phosphoenolpyruvic_acid synonyms

2-Propenoic acid, 2-(phosphonooxy)-, ion(1-); PHOSPHOENOLPYRUVATE; PEP; 2-(Phosphonooxy)acrylate; Phosphoenolpyruvate

Wikipedia:

Graphical representations:

phosphoenolpyruvic_acid

View large 3D structure

Molecular Formula: C3H5O6P

Natural Isotopic Abundance Mass: 168.041961

Mono-Isotopic Molecular Masses:

  • C12N14: 167.9823744031
  • C13N14: 170.9924389165
  • C12N15: 167.9823744031
  • C13N15: 170.9924389165

InChI string: InChI=1S/C3H5O6P/c1-2(3(4)5)9-10(6,7)8/h1H2,(H,4,5)(H2,6,7,8)

IUPAC: 2-(hydroxy-oxido-phosphoryl)oxyprop-2-enoic acid

PubChem Compound (CID): 6315
KEGG Compound ID: C00074
CAS Registry number: 73-89-2
ChEBI: 26055
EINECS: 200-804-3
PDB Compound ID: PEP

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)