BMRB

Biological Magnetic Resonance Data Bank


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

Pyrrolo[3,4-b]pyridine-5,7-dione

Pyrrolo[3,4-b]pyridine-5,7-dione bmse011996 - Data

Pyrrolo[3,4-b]pyridine-5,7-dione synonyms

Wikipedia:

Graphical representations:

pyrrolo[3,4-b]pyridine-5,7-dione

View large 3D structure

Molecular Formula: C7H4N2O2

Natural Isotopic Abundance Mass: 148.11886

Mono-Isotopic Molecular Masses:

  • C12N14: 148.027277378
  • C13N14: 155.05076124400003
  • C12N15: 150.02134716400002
  • C13N15: 157.04483103000004

InChI string: InChI=1S/C7H4N2O2/c10-6-4-2-1-3-8-5(4)7(11)9-6/h1-3H,(H,9,10,11)

EU-OPENSCREEN: EOS102710

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)