Adenine
Adenine synonyms
1H-Purine, 6-amino; 6-Amino-9H-purine; 3,6-Dihydro-6-iminopurine; 9H-Purine, 1,6-dihydro-6-imino-; 6-Amino-3H-purine; Leuco-4; 1H-Purin-6-amine; Purine, 6-amino-; Vitamin B4; 1,6-Dihydro-6-iminopurine; Adeninimine
Graphical representations:
View large 3D structure
Molecular Formula: C5H5N5
Natural Isotopic Abundance Mass: 135.1267000000
Mono-Isotopic Molecular Masses:
- C12N14: 135.054495186
- C13N14: 140.071269376
- C12N15: 140.039669652
- C13N15: 145.0564438415
InChI string: InChI=1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10)
IUPAC: 7H-purin-6-amine
PubChem Compound (CID): 190KEGG Compound ID: C00147
CAS Registry number: 22051-90-7 42911-33-1 42911-34-2 520-75-2 73-24-5
ChEBI: 16708
CCRIS: 2556
NSC: 14666
EINECS: 200-796-1
PDB Compound ID: ADE ANE
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)