2-amino-N-[(10S,13R,20R)-3,35-dichloro-13,18,21-trihydroxy-12-oxo-10-propan-2-yl-8,22,39-trioxa-4,11,34,38-tetrazanonacyclo[27.6.1.12,5.16,9.115,19.07,20.020,24.023,28.033,36]nonatriaconta-1(35),2,4,6,9(38),15(37),16,18,23(28),24,26,29(36),30,32-tetradecaen-13-yl]-3-methylbutanamide

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酰胺类
• 英文名称: 2-amino-N-[(10S,13R,20R)-3,35-dichloro-13,18,21-trihydroxy-12-oxo-10-propan-2-yl-8,22,39-trioxa-4,11,34,38-tetrazanonacyclo[27.6.1.12,5.16,9.115,19.07,20.020,24.023,28.033,36]nonatriaconta-1(35),2,4,6,9(38),15(37),16,18,23(28),24,26,29(36),30,32-tetradecaen-13-yl]-3-methylbutanamide
• 化学式: C₄₀H₃₆Cl₂N₆O₈
• 分子量: 799.7
• InChiKey: IKDPRVSLMWFDPR-VSMNVUQNSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  56
• 可旋转键数：
  4
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  222
• 氢给体数：
  7
• 氢受体数：
  11

文献信息

• ISOLATED BACTERIAL STRAIN OF THE GENUS BURKHOLDERIA AND PESTICIDAL METABOLITES THEREFROM- FORMULATIONS AND USES
  申请人：Asolkar Ratnakar

  公开号：US20140221207A1

  公开（公告）日：2014-08-07

  A species of Burkholderia sp with no known pathogenicity to vertebrates but with pesticidal activity (e.g., plants, algae, arachnids, insects, fungi, weeds and nematodes) as well as methods for controlling algae using said species of Burkholderia . Also provided are natural products derived from a culture of said species and methods of controlling algae and/or arachnids using said natural products.