2-[[[20,26-Bis(3,5-dichloro-4-hydroxyphenyl)-17-[[2-(3,5-dichloro-4-hydroxyphenyl)-2-oxoacetyl]amino]-14,18,21,24,37-pentahydroxy-28-methyl-27-oxo-2-oxa-13,19,22,25,28-pentazahexacyclo[29.2.2.13,7.18,12.05,23.011,15]heptatriaconta-1(33),3,5,7(37),8(36),9,11,13,18,21,24,31,34-tridecaen-29-yl]-hydroxymethylidene]amino]-2-(4-hydroxyphenyl)acetic 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-[[[20,26-Bis(3,5-dichloro-4-hydroxyphenyl)-17-[[2-(3,5-dichloro-4-hydroxyphenyl)-2-oxoacetyl]amino]-14,18,21,24,37-pentahydroxy-28-methyl-27-oxo-2-oxa-13,19,22,25,28-pentazahexacyclo[29.2.2.13,7.18,12.05,23.011,15]heptatriaconta-1(33),3,5,7(37),8(36),9,11,13,18,21,24,31,34-tridecaen-29-yl]-hydroxymethylidene]amino]-2-(4-hydroxyphenyl)acetic acid
• 英文别名: 2-[[[20,26-bis(3,5-dichloro-4-hydroxyphenyl)-17-[[2-(3,5-dichloro-4-hydroxyphenyl)-2-oxoacetyl]amino]-14,18,21,24,37-pentahydroxy-28-methyl-27-oxo-2-oxa-13,19,22,25,28-pentazahexacyclo[29.2.2.13,7.18,12.05,23.011,15]heptatriaconta-1(33),3,5,7(37),8(36),9,11,13,18,21,24,31,34-tridecaen-29-yl]-hydroxymethylidene]amino]-2-(4-hydroxyphenyl)acetic acid
• 化学式: C₆₁H₄₅Cl₆N₇O₁₆
• 分子量: 1344.8
• InChiKey: ZFUGTFLRENMBAG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.5
• 重原子数：
  90
• 可旋转键数：
  9
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  377
• 氢给体数：
  12
• 氢受体数：
  21

文献信息

• ANTIFUNGAL COMPOSITION COMPRISING POLYCYCLIC PEPTIDE COMPOUND AND METHOD FOR PREPARING THE SAME
  申请人：Kim Won Gon

  公开号：US20140030242A1

  公开（公告）日：2014-01-30

  Disclosed are a novel strain with antibacterial activity, identified as Streptomyces sp. AN1542 strain (Accession No.: KCTC 12113BP), an antibacterial composition comprising a compound represented by Chemical Formula 1 or 2, or a strain producing the same as an active ingredient, and a method for producing the same. Exhibiting potent antibacterial activity against pathogenic microbes and antibiotic-resistant microbes, particularly, MRSA, QRSA, VRSA and VRE, the compound or the strain of the present invention can be applied to the treatment of infectious diseases caused by superbacteria.