2-[2-[[2-[18-(2-Amino-2-oxoethyl)-35-(3-hydroxybutan-2-yl)-25-[hydroxy(phenyl)methyl]-32-[(4-hydroxyphenyl)methyl]-21-methyl-16,23,30,33-tetraoxo-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,41,42,43-decazaheptacyclo[34.2.1.12,5.112,15.119,22.126,29.06,11]tritetraconta-1(38),2(43),4,6(11),7,9,12(42),14,19(41),21,26(40),28,36(39)-tridecaen-8-yl]-1,3-thiazole-4-carbonyl]amino]prop-2-enoylamino]prop-2-enoic acid

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 2-[2-[[2-[18-(2-Amino-2-oxoethyl)-35-(3-hydroxybutan-2-yl)-25-[hydroxy(phenyl)methyl]-32-[(4-hydroxyphenyl)methyl]-21-methyl-16,23,30,33-tetraoxo-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,41,42,43-decazaheptacyclo[34.2.1.12,5.112,15.119,22.126,29.06,11]tritetraconta-1(38),2(43),4,6(11),7,9,12(42),14,19(41),21,26(40),28,36(39)-tridecaen-8-yl]-1,3-thiazole-4-carbonyl]amino]prop-2-enoylamino]prop-2-enoic acid
• 化学式: C₅₉H₅₂N₁₄O₁₂S₆
• 分子量: 1341.5
• InChiKey: AESYHMPUIGHGIN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  91
• 可旋转键数：
  14
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  575
• 氢给体数：
  11
• 氢受体数：
  25

文献信息

• ANTIBACTERIAL COMPOUNDS AND PROCESSES FOR ITS PRODUCTION
  申请人：Lamarche Matthew J.

  公开号：US20100093615A1

  公开（公告）日：2010-04-15

  This invention relates to a novel antibiotic compounds, pharmaceutically acceptable salts and derivatives thereof, and to methods for obtaining such compounds.
• THIOPEPTIDE PRECURSOR PROTEIN, GENE ENCODING IT AND USES THEREOF
  申请人：Morris Rowan

  公开号：US20110183374A1

  公开（公告）日：2011-07-28

  The present invention relates to the precursor proteins for thiopeptide biosynthesis, and the corresponding structural genes and uses thereof. The present invention also relates to methods for genetically manipulating the thiopeptide precursor protein or host cells expressing a gene encoding said thiopeptide precursor protein to produce thiopeptide compounds or their derivatives. The present invention further relates to the cloning and characterization of genes involved in thiopeptide biosynthesis and their use in thiopeptide compounds production.
• US8183341B2
  申请人：——

  公开号：US8183341B2

  公开（公告）日：2012-05-22