[(2R,3S,5S)-3-[5-(1-decyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentanoyloxy]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phosphate

• 常用名: [(2R,3S,5S)-3-[5-(1-decyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentanoyloxy]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phosphate
• 英文名: [(2R,3S,5S)-3-[5-(1-decyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentanoyloxy]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phosphate
• CAS号: 101011-06-7
• 分子量: 656.74800
• 密度: N/A
• 沸点: N/A
• 分子式: C₃₁H₅₃N₄O₉P
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: [(2R,3S,5S)-3-[5-(1-decyl-1,4-diazoniabicyclo[2.2.2]octan-4-yl)pentanoyloxy]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phosphate

物理化学性质

• 分子式: C₃₁H₅₃N₄O₉P
• 分子量: 656.74800
• 精确质量: 656.35500
• PSA: 172.62000
• LogP: 3.91940
• InChIKey: XOELTOAOMKZBFT-DSCYDMRWSA-N
• SMILES: CCCCCCCCCC[N+]12CC[N+](CCCCC(=O)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(=O)([O-])[O-])(CC1)CC2

英文别名

• 5'-Thymidylic acid,3'-(5-(4-decyl-1,4-diazoniabicyclo(2.2.2)oct-1-yl)pentanoate),dihydroxide,bis(inner salt)