cis-Bicyclo<3.3.0>octan-2,6-diol | 17572-86-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: cis-Bicyclo<3.3.0>octan-2,6-diol
• 英文别名: optically inactive (3ar,6ac)-octahydro-pentalene-1ξ,4ξ-diol；Opt.-inakt. (3ar,6ac)-Octahydro-pentalen-1ξ,4ξ-diol；(3aS,6aS)-1,2,3,3a,4,5,6,6a-octahydropentalene-1,4-diol
• CAS: 17572-86-0；32652-65-6；37940-19-5；110217-06-6；110269-89-1；110269-94-8
• 化学式: C₈H₁₄O₂
• 分子量: 142.198
• InChiKey: ZAQZPNNBRRVLSI-LHZZQDSXSA-N

物化性质

• 沸点：
  298.4±8.0 °C(Predicted)
• 密度：
  1.216±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  10
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  40.5
• 氢给体数：
  2
• 氢受体数：
  2

安全信息

• 海关编码：
  2912299000

反应信息

• 作为反应物：
  描述：

  cis-Bicyclo<3.3.0>octan-2,6-diol 在 sodium tetrahydroborate 、 Jones ox 、 三氟化硼乙醚 、 magnesium 作用下， 以 乙醚 为溶剂， 生成
  参考文献：
  名称：

  环戊烷环化的简单方法

  摘要：

  我们已经开发了一种使用廉价试剂进行环戊烷环化的简单方法，该方法可用于合成聚喹烷体系。

  DOI：

  10.1016/s0040-4039(97)00912-x
• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 lithium aluminium tetrahydride 作用下， 生成 cis-Bicyclo<3.3.0>octan-2,6-diol
  参考文献：
  名称：

  Dauben et al., Huaxue Xuebao/Acta Chimica Sinica, 1957, vol. 23, p. 411,417

  摘要：

  DOI：

文献信息

• [EN] NOVEL TRICYCLIC COMPOUNDS AS INHIBITORS OF MUTANT IDH ENZYMES<br/>[FR] NOUVEAUX COMPOSÉS TRICYCLIQUES UTILISÉS EN TANT QU'INHIBITEURS D'ENZYMES IDH MUTANTES
  申请人：MERCK SHARP & DOHME

  公开号：WO2016089830A1

  公开（公告）日：2016-06-09

  The present invention is directed to tricyclic compounds of formula (I) which are inhibitors of one or more mutant IDH enzymes (I); wherein A is -C(R1)= or -N=; and X is selected from the group consisting of: (II-i), and (II-ii). The present invention is also directed to uses of the tricyclic compounds described herein in the potential treatment or prevention of cancers in which one or more mutant IDH enzymes are involved. The present invention is also directed to compositions comprising these compounds. The present invention is also directed to uses of these compositions in the potential prevention or treatment of such cancers.

  本发明涉及式(I)的三环化合物，其为一种或多种突变IDH酶的抑制剂；其中A为-C(R1)=或-N=；X从以下组中选择：(II-i)和(II-ii)。本发明还涉及所述三环化合物在潜在治疗或预防涉及一种或多种突变IDH酶的癌症中的用途。本发明还涉及包含这些化合物的组合物。本发明还涉及这些组合物在潜在预防或治疗此类癌症中的用途。
• [EN] NOVEL TRICYCLIC COMPOUNDS AS INHIBITORS OF MUTANT IDH ENZYMES<br/>[FR] NOUVEAUX COMPOSÉS TRICYCLIQUES COMME INHIBITEURS D'ENZYMES IDH MUTANTES
  申请人：MERCK SHARP & DOHME

  公开号：WO2016089833A1

  公开（公告）日：2016-06-09

  The present invention is directed to tricyclic compounds of formula (I) which are inhibitors of one or more mutant IDH enzymes: (I); wherein A is -C(R1)= or -N=; and X is selected from the group consisting of: (II-i), (II-ii), (II-iii), and (II-iv). The present invention is also directed to uses of the tricyclic compounds described herein in the potential treatment or prevention of cancers in which one or more mutant IDH enzymes are involved. The present invention is also directed to compositions comprising these compounds. The present invention is also directed to uses of these compositions in the potential prevention or treatment of such cancers.

  本发明涉及式(I)的三环化合物，这些化合物是一种或多种突变IDH酶的抑制剂：(I)；其中A为-C(R1)=或-N=；X选自以下组中的一种：(II-i)、(II-ii)、(II-iii)和(II-iv)。本发明还涉及所述三环化合物在潜在治疗或预防涉及一种或多种突变IDH酶的癌症中的用途。本发明还涉及包含这些化合物的组合物。本发明还涉及这些组合物在潜在预防或治疗此类癌症中的用途。
• Synthetic Studies Towards Novel Terpenic Natural Products Kelsoene and Poduran: Construction of the Complete 4-5-5-Fused Tricarbocyclic Core
  作者：Goverdhan Mehta、K. Srinivas

  DOI：10.1055/s-1999-2670

  日期：1999.5

  A common synthetic approach to the recently reported sesquiterpene kelsoene 1 and the tetraterpene poduran 5, bearing a novel tricyclo[6.2.0.02,6]decane framework, from commercially available 1,5-COD and leading to the first construction of the carbocyclic core present in these natural products is delineated.

  本文介绍了一种常见的合成方法，即利用市售的 1,5-COD 合成最近报道的倍半萜酮烯 1 和四萜荚兰 5，它们带有新颖的三环[6.2.0.02,6]癸烷框架，并首次构建了这些天然产物中的碳环核心。
• Tricyclic compounds as inhibitors of mutant IDH enzymes
  申请人：Merck Sharp & Dohme Corp.

  公开号：US10086000B2

  公开（公告）日：2018-10-02

  The present invention is directed to tricyclic compounds of formula (I) which are inhibitors of one or more mutant IDH enzymes: (I); wherein A is —C(R1)= or —N═; and X is selected from the group consisting of: (II-i), (II-ii), (I) (II-iii), and (II-iv). The present invention is also directed to uses of the tricyclic compounds described herein in the potential treatment or prevention of cancers in which one or more mutant IDH enzymes are involved. The present invention is also directed to compositions comprising these compounds. The present invention is also directed to uses of these compositions in the potential prevention or treatment of such cancers.

  本发明涉及式(I)的三环化合物，它是一种或多种突变IDH酶的抑制剂：(I)；其中A是-C(R1)＝或-N═；X选自由(II-i)、(II-ii)、(I)(II-iii)和(II-iv)组成的组。本发明还涉及本文所述三环化合物在潜在治疗或预防涉及一种或多种突变 IDH 酶的癌症中的用途。本发明还涉及包含这些化合物的组合物。本发明还涉及这些组合物在潜在预防或治疗此类癌症中的用途。
• 421. Fused carbon rings. Part XX. Experiments directed towards the synthesis of simple pentalenes
  作者：C. T. Blood、R. P. Linstead

  DOI：10.1039/jr9520002255

  日期：——