1,N(6)-乙烯桥-2'-脱氧腺苷 5'-三磷酸酯
[CAS# 81004-54-8]

基本信息

• 产品名称: 1,N(6)-乙烯桥-2'-脱氧腺苷 5'-三磷酸酯
• 英文名: 1,N(6)-Etheno-2'-Deoxyadenosine 5'-Triphosphate
• 别名: [(2R,3S,5R)-3-Hydroxy-5-Imidazo[2,1-F]Purin-3-Yl-Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate; [(2R,3S,5R)-3-Hydroxy-5-(3-Imidazo[2,1-F]Purinyl)-2-Tetrahydrofuranyl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate; [(2R,3S,5R)-3-Hydroxy-5-Imidazo[2,1-F]Purin-3-Yl-Oxolan-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate
• 分子式: C₁₂H₁₆N₅O₁₂P₃
• 分子量: 515.21
• CAS 登录号: 81004-54-8
• 分子行输入简码 SMILES: [C@H]1(O[C@@H]([C@@H](O)C1)CO[P](O[P](O[P](=O)(O)O)(=O)O)(=O)O)[N]2C4=C(N=C2)C3=NC=C[N]3C=N4
• 国际化学标识码 InChI: 1S/C12H16N5O12P3/c18-7-3-9(17-6-14-10-11-13-1-2-16(11)5-15-12(10)17)27-8(7)4-26-31(22,23)29-32(24,25)28-30(19,20)21/h1-2,5-9,18H,3-4H2,(H,22,23)(H,24,25)(H2,19,20,21)/t7-,8+,9+/m0/s1
• 国际化学标识检索码 InChIKey: OLJFCGDEGHURMU-DJLDLDEBSA-N

物理化学性质

• 密度: 2.422g/cm³ （计算值）