Adenosindiphosphorsaeure; 20398-34-9; Adenosine 5'-pyrophosphate; Adenosine-5'-diphosphat; Adenosine diphosphate; BRN 0067722; Adenosine 5'-diphosphoric acid; Adenosine-5'-diphosphate; Adenosine diphosphoric acid; ADP (nucleotide); Ado-5'-P-P
Molecular Formula: C10H15N5O10P2
Natural Isotopic Abundance Mass: 427.2011220000
Mono-Isotopic Molecular Masses:
InChI string: InChI=1/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1/f/h18-19,21H,11H2
IUPAC: [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxyphosphonic acid
PubChem Compound (CID): 6022Reference 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)