Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Inosine 5'-monophosphate

Graphical representations:


View large 3D structure

Molecular Formula: C10H13N4O8P

Natural Isotopic Abundance Mass: 348.2059810000

Mono-Isotopic Molecular Masses:

  • C12N14: 348.047099925
  • C13N14: 358.080648303
  • C12N15: 352.035239498
  • C13N15: 362.0687878757

InChI string: InChI=1S/C10H13N4O8P/c15-6-4(1-21-23(18,19)20)22-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17/h2-4,6-7,10,15-16H,1H2,(H,11,12,17)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1

IUPAC: [(2R,3R,4R,5R)-3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methoxyphosphonic acid

PubChem Compound (CID): 8582
KEGG Compound ID: C00130
CAS Registry number: 131-99-7 138240-72-9 485-83-6
ChEBI: 17202
EINECS: 205-045-1
PDB Compound ID: IMP

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,