S-(5'-Adenosyl)-L-methionine
S_adenosyl_L_methionine synonyms
AdoMet; Ademetionine; Methioninyladenylate; Donamet; (3S)-5'-((3-Amino-3-carboxylatopropyl)methylsulphonio)-5'-deoxyadenosine; Methionine, S-adenosyl-; S-Adenosyl-L-methionine; L-Methionine, S-adenosyl-; Adenosine, 5'-((L-3-amino-3-carboxypropyl)methylsulfonio)-5'-deoxy-, hydroxide, inner salt; SAMe; Adenosine, 5'-(((3S)-3-amino-3-carboxypropyl)methylsulfonio)-5'-deoxy-, inner salt
Graphical representations:
View large 3D structure
Molecular Formula: C15H23N6O5S+
Natural Isotopic Abundance Mass: 399.44532
Mono-Isotopic Molecular Masses:
- C12N14: 399.14506357
- C13N14: 414.195386137
- C12N15: 405.1272729292
- C13N15: 420.1775954962
InChI string: InChI=1S/C15H22N6O5S/c1-27(3-2-7(16)15(24)25)4-8-10(22)11(23)14(26-8)21-6-20-9-12(17)18-5-19-13(9)21/h5-8,10-11,14,22-23H,2-4,16H2,1H3,(H2-,17,18,19,24,25)/p+1/t7-,8+,10+,11+,14+,27+/m0/s1
IUPAC: (2S)-2-amino-4-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl-methyl-sulfonio]butanoate
PubChem Compound (CID): 34755KEGG Compound ID: C00019
CAS Registry number: 23095-97-8 2613-02-7 28378-99-6 29908-03-0 5134-37-2 86522-35-2 86866-89-9
ChEBI: 15414
EINECS: 249-946-8
CCRIS: 7130
PDB Compound ID: EEM SAM
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)