(1R,2R,6R,8R)-13-[5-[(4S,5R)-4-hydroxy-4-[(4R,5R)-5-hydroxy-2,2-dimethyl-1,3-dioxolan-4-yl]-5-methyl-5,6-dihydropyrrolo[1,2-c]triazol-3-yl]furan-2-yl]-4,4-dimethyl-3,5,7-trioxa-10,11,12-triazatetracyclo[6.6.0.02,6.010,14]tetradeca-11,13-dien-1-ol

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 呋喃吡咯
• 英文名称: (1R,2R,6R,8R)-13-[5-[(4S,5R)-4-hydroxy-4-[(4R,5R)-5-hydroxy-2,2-dimethyl-1,3-dioxolan-4-yl]-5-methyl-5,6-dihydropyrrolo[1,2-c]triazol-3-yl]furan-2-yl]-4,4-dimethyl-3,5,7-trioxa-10,11,12-triazatetracyclo[6.6.0.02,6.010,14]tetradeca-11,13-dien-1-ol
• 化学式: C₂₅H₃₀N₆O₉
• 分子量: 558.5
• InChiKey: KNXDRHYTFBMBEK-JAGFXBATSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2
• 重原子数：
  40
• 可旋转键数：
  3
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  181
• 氢给体数：
  3
• 氢受体数：
  13

文献信息

• [EN] SUBSTITUTED SUGAR DERIVED 1, 2, 3-TRIAZOLE COMPOUNDS AND THEIR DIMERS AND A PROCESS FOR THE PREPARATION THEREOF<br/>[FR] COMPOSÉS 1, 2, 3-TRIAZOLES DÉRIVÉS DE SUCRES SUBSTITUÉS ET LEURS DIMÈRES AINSI QU'UN PROCÉDÉ POUR LEUR PRÉPARATION
  申请人：COUNCIL SCIENT IND RES

  公开号：WO2014132273A1

  公开（公告）日：2014-09-04

  The present invention discloses tricyclic five membered sugar derived 1,2,3-triazoles compounds of formula I and their dimers and a process for the preparation thereof. Particularly, the present invention relates to tricyclic five membered sugar derived 1,2,3-triazoles compounds of formula I which are useful for screening of various kinases and other related targets. [Insert formula I here] wherein R is selected from hydrogen, (un)substituted or substituted alkyl, (un)substituted or substituted aryl, (un)substituted or substituted cycloalkyls, (un)substituted or substituted heteroaryls.