Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Nicotinamide D-ribonucleotide

Graphical representations:

Nicotinamide D-ribonucleotide image

Molecular Formula: C11 H15 N2 O8 P

Natural Isotopic Abundance Mass: 334.2191610000

Mono-Isotopic Molecular Masses:

  • C12N14: 334.056601979
  • C13N14: 345.093505194
  • C12N15: 336.050671765
  • C13N15: 347.0875749809

InCHi String:

canonical SMILES: C1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)(O)[O-])O)O)C(=O)N

IUPAC: IUPAC systematic

IUPAC traditional: IUPAC openeye: IUPAC cas

PubChem Substance (SID):   85165066   157468   3741
PubChem Compound (CID):   14180
KEGG: Compound ID   C00455
CAS Registry IDs:   1094-61-7
PDB Chemical Component   NMN
Miscellaneous Databases and IDs:   ChemIDplus 001094617   EINECS 214-136-5

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.