1-ethyl-2-[5-[1-[6-[3-[4-[[7-[(2R,5R)-4-hydroxy-5-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxymethyl]oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-4-yl]carbamoyl]-3-nitrophenyl]prop-2-ynylamino]-6-oxohexyl]-3,3-dimethyl-5-sulfoindol-1-ium-2-yl]penta-2,4-dienylidene]-3,3-dimethylindole-5-sulfonic acid

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 1-ethyl-2-[5-[1-[6-[3-[4-[[7-[(2R,5R)-4-hydroxy-5-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxymethyl]oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-4-yl]carbamoyl]-3-nitrophenyl]prop-2-ynylamino]-6-oxohexyl]-3,3-dimethyl-5-sulfoindol-1-ium-2-yl]penta-2,4-dienylidene]-3,3-dimethylindole-5-sulfonic acid
• 化学式: C54H62N8O22P3S2+
• 分子量: 1332.2
• InChiKey: ZOCNQLVEVYTJNO-PBBLGSIASA-O

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  89
• 可旋转键数：
  24
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  456
• 氢给体数：
  9
• 氢受体数：
  25

文献信息

• NUCLEOTIDE ANALOGS
  申请人：Siddiqi Suhaib

  公开号：US20100203541A1

  公开（公告）日：2010-08-12

  The disclosure provides nucleotide analogs and methods of their use. Analogs of the invention comprise a reporter molecule (label) attached via the N4, N6, O4, or O6 position of the nitrogenous base portion of the analog. In a preferred embodiment, nucleotide analogs of the invention comprise a label attached to the nitrogenous base portion of the analog via a cleavable linker at the N4, O4, N6 or O6 position.
• US7956171B2
  申请人：——

  公开号：US7956171B2

  公开（公告）日：2011-06-07