2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[6-[[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methylbutyl]amino]-2-[[(2S)-5-oxo-2-[2-[[2,3,4-trimethoxy-6-[(4-methoxyphenyl)methylsulfanyl]phenyl]methylamino]propanoylamino]-5-(tritylamino)pentanoyl]amino]hexanoyl]amino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoyl]amino]-5-[(N-methylcarbamimidoyl)amino]pentanoyl]amino]-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-5-[(N-methylcarbamimidoyl)amino]pentanoyl]amino]acetic acid

• 分子结构分类: 有机化合物 - 有机聚合物 - 多肽
• 英文名称: 2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[6-[[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methylbutyl]amino]-2-[[(2S)-5-oxo-2-[2-[[2,3,4-trimethoxy-6-[(4-methoxyphenyl)methylsulfanyl]phenyl]methylamino]propanoylamino]-5-(tritylamino)pentanoyl]amino]hexanoyl]amino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoyl]amino]-5-[(N-methylcarbamimidoyl)amino]pentanoyl]amino]-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-5-[(N-methylcarbamimidoyl)amino]pentanoyl]amino]acetic acid
• 化学式: C₁₁₆H₁₆₀N₁₈O₂₁S
• 分子量: 2174.7
• InChiKey: UERKZDYNSGSPFJ-KGCXSQHNSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.9
• 重原子数：
  156
• 可旋转键数：
  68
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.48
• 拓扑面积：
  580
• 氢给体数：
  19
• 氢受体数：
  26

文献信息

• Homogeneous Erythropoietin and Other Peptides and Proteins, Methods and Intermediates for Their Preparation
  申请人：Danishefsky Samuel J.

  公开号：US20100081786A1

  公开（公告）日：2010-04-01

  The present invention provides isolated homogeneous polyfunctionalized proteins (e.g., erythropoietin), isolated glycopeptides, and a method for preparing polyfunctionalized peptides and/or proteins via cysteine-free native chemical ligation. In certain embodiments, the invention provides an isolated homogeneous polyfunctionalized protein having the structure (I). In certain other embodiments, the invention provides an isolated glycopeptide having Formula (II). In certain other embodiments, the inventive method is a method for preparing a polyfunctionalized peptide comprising a peptidic backbone made up of four or more amino acids, wherein two or more non-adjacent amino acids are independently substituted with a moiety having the structure (III)-LH. wherein A and L1 are as defined herein.
• US8754192B2
  申请人：——

  公开号：US8754192B2

  公开（公告）日：2014-06-17