S-Inosylhomocysteine
[CAS# 22365-14-6]

Identification

• Name: S-Inosylhomocysteine
• Synonyms: 2-Amino-4-[[(2S,3S,4R,5R)-3,4-Dihydroxy-5-(6-Oxo-3H-Purin-9-Yl)Tetrahydrofuran-2-Yl]Methylsulfanyl]Butanoic Acid; 2-Amino-4-[[(2S,3S,4R,5R)-3,4-Dihydroxy-5-(6-Oxo-3H-Purin-9-Yl)-2-Tetrahydrofuranyl]Methylthio]Butanoic Acid; 2-Amino-4-[[(2S,3S,4R,5R)-3,4-Dihydroxy-5-(6-Keto-3H-Purin-9-Yl)Tetrahydrofuran-2-Yl]Methylthio]Butyric Acid
• Molecular Formula: C₁₄H₁₉N₅O₆S
• Molecular Weight: 385.39
• CAS Registry Number: 22365-14-6
• SMILES: [C@@H]1(O)[C@H](O)[C@H](O[C@H]1[N]2C3=C(N=C2)C(=O)N=CN3)CSCCC(N)C(O)=O
• InChI: 1S/C14H19N5O6S/c15-6(14(23)24)1-2-26-3-7-9(20)10(21)13(25-7)19-5-18-8-11(19)16-4-17-12(8)22/h4-7,9-10,13,20-21H,1-3,15H2,(H,23,24)(H,16,17,22)/t6?,7-,9-,10-,13-/m1/s1
• InChIKey: VNPWVMVYUSNFAW-ZRURSIFKSA-N