4-[[(1E,38E)-12,33,36,36-tetramethyl-18,23-dioxo-5-propyl-9-sulfo-5,19,22-triaza-29-azoniahexacyclo[38.3.1.04,12.06,11.029,37.030,35]tetratetraconta-1,3,6(11),7,9,29(37),30(35),31,33,38,40(44)-undecaen-44-yl]oxy]benzoic 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: 4-[[(1E,38E)-12,33,36,36-tetramethyl-18,23-dioxo-5-propyl-9-sulfo-5,19,22-triaza-29-azoniahexacyclo[38.3.1.04,12.06,11.029,37.030,35]tetratetraconta-1,3,6(11),7,9,29(37),30(35),31,33,38,40(44)-undecaen-44-yl]oxy]benzoic acid
• 化学式: C54H67N4O8S+
• 分子量: 932.2
• InChiKey: QBIRMTHWCGIHEN-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  8.6
• 重原子数：
  67
• 可旋转键数：
  6
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  174
• 氢给体数：
  4
• 氢受体数：
  9

文献信息

• Reactive 1,3'-crosslinked carbocyanines and their bioconjugates
  申请人：Diwu Zhenjun

  公开号：US20100022768A1

  公开（公告）日：2010-01-28

  Chemically reactive carbocyanine dyes that are intramolecularly crosslinked between the 1-position and 3′-position, their bioconjugates and their uses are described. 1,3′-crosslinked carbocyanines are superior to those of conjugates of spectrally similar 1,1′-crosslinked or non-crosslinked dyes. The invention includes derivative compounds having one or more benzo nitrogens.
• Conjugates of biological substances
  申请人：Diwu Zhenjun

  公开号：US20110003362A1

  公开（公告）日：2011-01-06

  Chemically reactive carbocyanine dyes that are intramolecularly crosslinked between the 1-position and 3′-position, their bioconjugates and their uses are described. 1,3′-crosslinked carbocyanines are superior to those of conjugates of spectrally similar 1,1′-crosslinked or non-crosslinked dyes. The invention includes derivative compounds having one or more benzo nitrogens.
• US7989638B2
  申请人：——

  公开号：US7989638B2

  公开（公告）日：2011-08-02
• US8034927B2
  申请人：——

  公开号：US8034927B2

  公开（公告）日：2011-10-11
• US8093404B2
  申请人：——

  公开号：US8093404B2

  公开（公告）日：2012-01-10