(8aR)-13-amino-4t,15,16-trihydroxy-1t-methoxy-12-methyl-(8ar)-1,2,3,4,8a,13-hexahydro-9H-chromeno[3',2':6,7][1,3]dioxino[4',5',6':4,5]naphtho[2,1-g]isoquinoline-5,14-dione | 54713-46-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: (8aR)-13-amino-4t,15,16-trihydroxy-1t-methoxy-12-methyl-(8ar)-1,2,3,4,8a,13-hexahydro-9H-chromeno[3',2':6,7][1,3]dioxino[4',5',6':4,5]naphtho[2,1-g]isoquinoline-5,14-dione
• 英文别名: Albofungin；6-amino-3,21,28-trihydroxy-24-methoxy-7-methyl-14,16,26-trioxa-6-azaheptacyclo[15.11.1.02,11.04,9.013,29.018,27.020,25]nonacosa-1(28),2(11),3,7,9,17(29),18(27),20(25)-octaene-5,19-dione
• CAS: 54713-46-1
• 化学式: C₂₇H₂₄N₂O₉
• 分子量: 520.496
• InChiKey: LYKFTVCDYGGLGW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  38
• 可旋转键数：
  1
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  161
• 氢给体数：
  4
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  (8aR)-13-amino-4t,15,16-trihydroxy-1t-methoxy-12-methyl-(8ar)-1,2,3,4,8a,13-hexahydro-9H-chromeno[3',2':6,7][1,3]dioxino[4',5',6':4,5]naphtho[2,1-g]isoquinoline-5,14-dione 生成 3-acetyl-11-benzylideneamino-1,2,13-trihydroxy-10-methyl-6a,11-dihydro-7H-[1,3]dioxino[4',5',6':4,5]naphtho[2,1-g]isoquinolin-12-one
  参考文献：
  名称：

  Gurevich,A.N. et al., Doklady Chemistry, 1972, vol. 207, p. 953 - 956

  摘要：

  DOI：

文献信息

• [EN] NEW USE AS ANTIHELMINTICS OF ALBOFUNGIN AND ANALOGS<br/>[FR] NOUVELLE UTILISATION D'ALBOFUNGINE ET D'ANALOGUES EN TANT QU'ANTI-HELMINTHES
  申请人：NOVARTIS AG

  公开号：WO2001095909A1

  公开（公告）日：2001-12-20

  Described is use of the known compounds of the formula I wherein X is hydrogen or chlorine, against helminths in humans, and preferably in companion and meet-producing animals. These compounds can be used in the manufacture of a composition, which is capable of protecting humans and animals against a broad range of helminths. These compounds are able to reduce, inhibit or otherwise retard growth, viability and/or egg fecundity of said helminths and/or to ameliorate the symptoms of helminth infection. Another aspect of the present invention contemplates a method of controlling helminths in humans and animals, and more particularly nematode, infection, growth, viability and/or egg fecundity and/or ameliorating the symptoms of helminth infection by the administration of a compound of the formula I to helminth-susceptible animals or humans.
• Gurevich,A.N. et al., Doklady Chemistry, 1972, vol. 207, p. 953 - 956
  作者：Gurevich,A.N. et al.

  DOI：——

  日期：——