2-Amino-4-({[5-(6-Amino-9H-Purin-9-Yl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl}Sulfanyl)Butanoic Acid
[CAS# 53276-26-9]

Identification

• Name: 2-Amino-4-({[5-(6-Amino-9H-Purin-9-Yl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl}Sulfanyl)Butanoic Acid
• Synonyms: (R)-2-Amino-4-((((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)thio)butanoic acid; 2-Amino-4-[5-(6-amino-purin-9-yl)-3,4-dihydroxy-tetrahydro-furan-2-ylmethylsulfanyl]-butyric acid; adenosylhomo-cys
• Molecular Formula: C₁₄H₂₀N₆O₅S
• Molecular Weight: 384.41
• CAS Registry Number: 53276-26-9
• SMILES: O=C(O)C(N)CCSCC3OC(n2cnc1c(ncnc12)N)C(O)C3O
• InChI: 1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)
• InChIKey: ZJUKTBDSGOFHSH-UHFFFAOYSA-N

Properties

• Density: 1.912g/cm³ (Cal.)
• Boiling point: 787.457°C at 760 mmHg (Cal.)
• Flash point: 430.038°C (Cal.)