eudistomin Y12 | 1384431-89-3

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 哈马拉生物碱
• 英文名称: eudistomin Y12
• 英文别名: [2-bromo-4-[(6-bromo-9H-pyrido[3,4-b]indol-1-yl)-hydroxymethyl]phenyl] 4-methylbenzenesulfonate
• CAS: 1384431-89-3
• 化学式: C₂₅H₁₈Br₂N₂O₄S
• 分子量: 602.303
• InChiKey: YWBMOWQMJIWLMG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6
• 重原子数：
  34
• 可旋转键数：
  5
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  101
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  eudistomin Y12 在 lithium aluminium tetrahydride 、 水 、 sodium hydroxide 作用下， 以 四氢呋喃 为溶剂， 反应 1.0h， 以3.1 mg的产率得到eudistomin Y13
  参考文献：
  名称：

  Beta-carboline alkaloids derived from the ascidian Synoicum sp.

  摘要：

  Six beta-carboline alkaloids (1-6) of the eudistomin Y class were isolated from the Korean ascidian Synoicum sp. These compounds were chemically converted to a known compound, eudistomin Y-1 (7) and six new derivatives, designated eudistomins Y-8-Y-13 (8-13). Several of these natural and synthetic compounds exhibited moderate to significant antimicrobial activity, weak cytotoxic activity, and inhibitory activities toward sortase A, isocitrate lyase, and Na+/K+-ATPase. Structure-activity relationships were also deduced. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2012.05.002
• 作为产物：
  描述：

  eudistomin Y₄ 在 sodium tetrahydroborate 、 三乙胺 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 6.0h， 生成 eudistomin Y12
  参考文献：
  名称：

  Beta-carboline alkaloids derived from the ascidian Synoicum sp.

  摘要：

  Six beta-carboline alkaloids (1-6) of the eudistomin Y class were isolated from the Korean ascidian Synoicum sp. These compounds were chemically converted to a known compound, eudistomin Y-1 (7) and six new derivatives, designated eudistomins Y-8-Y-13 (8-13). Several of these natural and synthetic compounds exhibited moderate to significant antimicrobial activity, weak cytotoxic activity, and inhibitory activities toward sortase A, isocitrate lyase, and Na+/K+-ATPase. Structure-activity relationships were also deduced. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2012.05.002

文献信息

• Beta-carboline alkaloids derived from the ascidian Synoicum sp.
  作者：Tae Hyung Won、Ju-eun Jeon、So-Hyoung Lee、Boon Jo Rho、Ki-Bong Oh、Jongheon Shin

  DOI：10.1016/j.bmc.2012.05.002

  日期：2012.7

  Six beta-carboline alkaloids (1-6) of the eudistomin Y class were isolated from the Korean ascidian Synoicum sp. These compounds were chemically converted to a known compound, eudistomin Y-1 (7) and six new derivatives, designated eudistomins Y-8-Y-13 (8-13). Several of these natural and synthetic compounds exhibited moderate to significant antimicrobial activity, weak cytotoxic activity, and inhibitory activities toward sortase A, isocitrate lyase, and Na+/K+-ATPase. Structure-activity relationships were also deduced. (C) 2012 Elsevier Ltd. All rights reserved.