Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Cyclic AMP

Graphical representations:


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Molecular Formula: C10H12N5O6P

Natural Isotopic Abundance Mass: 329.2059410000

Mono-Isotopic Molecular Masses:

  • C12N14: 329.052519654
  • C13N14: 339.086068032
  • C12N15: 334.03769412
  • C13N15: 339.086068032

InChI string: InChI=1/C10H12N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7-4(20-10)1-19-22(17,18)21-7/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13)/t4-,6-,7-,10-/m1/s1/f/h17H,11H2

IUPAC: (1R,6R,7R,8R)-8-(6-aminopurin-9-yl)-4-hydroxy-4-oxo-3,5,9-trioxa-3λ5-phosphabicyclo[4.3.0]nonan-7-ol

PubChem Compound (CID): 6076
KEGG Compound ID: C00575
CAS Registry number: 11002-78-1 37839-81-9 60-92-4
ChEBI: 17489
Beilstein Handbook Reference: 4-26-00-03618
EINECS: 200-492-9
CCRIS: 4291
NSC: 94017

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,