2,3-dimethoxy-strychnidin-10-one | 357-57-3

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 马钱子生物碱
• 英文名称: 2,3-dimethoxy-strychnidin-10-one
• 英文别名: Brucin；2,3-dimethoxy-strychnine；brucine；(4aR,13aS,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one
• CAS: 357-57-3
• 化学式: C₂₃H₂₆N₂O₄
• 分子量: 394.47
• InChiKey: RRKTZKIUPZVBMF-PSUSUFQKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  29
• 可旋转键数：
  2
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  51.2
• 氢给体数：
  0
• 氢受体数：
  5

文献信息

• [EN] ENANTIOENRICHED VIRIDICATUMTOXIN B ANALOGS<br/>[FR] ANALOGUES DE VIRIDICATUMTOXINE B ÉNANTIOENRICHIS
  申请人：UNIV RICE WILLIAM M

  公开号：WO2017180248A1

  公开（公告）日：2017-10-19

  In one aspect, the present disclosure provides derivatives of viridicatumtoxin of the formula wherein the variables are as defined herein. Also provided herein are compositions and methods of treating a bacterial infection, a viral infection, or in the treatment of cancer. The present disclosure also provides methods of synthesizing enantiopure viridicatumtoxin and other anthrone compounds.