Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

4-Nitrophenyl Phosphate

Graphical representations:

4-Nitrophenyl phosphate image

Molecular Formula: C6 H6 N O6 P

Natural Isotopic Abundance Mass: 219.0887010000

Mono-Isotopic Molecular Masses:

  • C12N14: 218.99327344
  • C13N14: 225.013402467
  • C12N15: 219.990308334
  • C13N15: 226.0104373604

InCHi String:

canonical SMILES: C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(O)O

IUPAC: IUPAC traditional: IUPAC openeye: IUPAC cas: IUPAC systematic
(4-nitrophenoxy)phosphonic acid

PubChem Substance (SID):   85165070   152714   6198
PubChem Compound (CID):   378
KEGG: Compound ID   C03360
CAS Registry IDs:   32348-90-6   4264-83-9   330-13-2   54306-27-3   32348-91-7
PDB Chemical Component   4NP
Miscellaneous Databases and IDs:   ChemIDplus 000330132   EINECS 206-353-9

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.