BMRB

Biological Magnetic Resonance Data Bank


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

1H-pyrazolo[3,4-b]pyridin-5-amine

1H-pyrazolo[3,4-b]pyridin-5-amine bmse012019 - Data

1H-pyrazolo[3,4-b]pyridin-5-amine synonyms

Wikipedia:

Graphical representations:

1H-pyrazolo[3,4-b]pyridin-5-amine

View large 3D structure

Molecular Formula: C6H6N4

Natural Isotopic Abundance Mass: 134.13863999999998

Mono-Isotopic Molecular Masses:

  • C12N14: 134.059246212
  • C13N14: 140.07937524000002
  • C12N15: 138.04738578400003
  • C13N15: 144.06751481200004

InChI string: InChI=1S/C6H6N4/c7-5-1-4-2-9-10-6(4)8-3-5/h1-3H,7H2,(H,8,9,10)

EU-OPENSCREEN: EOS102736

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)