S-Adenosyl-2-Methylmethionine
[CAS# 16720-69-7]

Identification

• Name: S-Adenosyl-2-Methylmethionine
• Synonyms: 2-Amino-4-[[(2S,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl-Methyl-Sulfonio]-2-Methyl-Butanoate; 2-Amino-4-[[(2S,3S,4R,5R)-5-(6-Amino-9-Purinyl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methyl-Methylsulfonio]-2-Methylbutanoate; 2-Amino-4-[[(2S,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl-Methyl-Sulfonio]-2-Methyl-Butyrate
• Molecular Formula: C₁₆H₂₄N₆O₅S
• Molecular Weight: 412.46
• CAS Registry Number: 16720-69-7
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H]1O)C[S+](CCC(N)(C([O-])=O)C)C)[N]2C3=C(N=C2)C(=NC=N3)N
• InChI: 1S/C16H24N6O5S/c1-16(18,15(25)26)3-4-28(2)5-8-10(23)11(24)14(27-8)22-7-21-9-12(17)19-6-20-13(9)22/h6-8,10-11,14,23-24H,3-5,18H2,1-2H3,(H2-,17,19,20,25,26)/t8-,10-,11-,14-,16?,28?/m1/s1
• InChIKey: DLGWCGJLTGONLY-AMDVVCNQSA-N