BMRB

Biological Magnetic Resonance Data Bank


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

N,2-dihydroxybenzamide

N,2-dihydroxybenzamide bmse011972 - Data

N,2-dihydroxybenzamide synonyms

Wikipedia:

Graphical representations:

N,2-dihydroxybenzamide

View large 3D structure

Molecular Formula: C7H7NO3

Natural Isotopic Abundance Mass: 153.13538

Mono-Isotopic Molecular Masses:

  • C12N14: 153.042593089
  • C13N14: 160.06607695500003
  • C12N15: 154.039627982
  • C13N15: 161.06311184800003

InChI string: InChI=1S/C7H7NO3/c9-6-4-2-1-3-5(6)7(10)8-11/h1-4,9,11H,(H,8,10)

BMRB Ligand Expo: SHA
EU-OPENSCREEN: EOS102683

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)