3-Methyl-2-[[3-methyl-2-[(4-oxo-3-propan-2-yloxetane-2-carbonyl)amino]butanoyl]amino]butanoic 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: 3-Methyl-2-[[3-methyl-2-[(4-oxo-3-propan-2-yloxetane-2-carbonyl)amino]butanoyl]amino]butanoic acid
• 英文别名: 3-methyl-2-[[3-methyl-2-[(4-oxo-3-propan-2-yloxetane-2-carbonyl)amino]butanoyl]amino]butanoic acid
• 化学式: C₁₇H₂₈N₂O₆
• 分子量: 356.4
• InChiKey: PDPYJYDVMZXUKQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  25
• 可旋转键数：
  8
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.76
• 拓扑面积：
  122
• 氢给体数：
  3
• 氢受体数：
  6

文献信息

• Cystargolide compounds and uses thereof
  申请人：UNIVERSITY OF PRINCE EDWARD ISLAND

  公开号：US10662221B2

  公开（公告）日：2020-05-26

  There is provided herein compounds of formula I, wherein R1 is H or linear or branched C1-C6 lower alkyl; R2 is H, linear or branched C1-C6 lower alkyl, or a proteinogenic amino acid side chain; R3 is H, linear or branched C1-C6 lower alkyl, or a proteinogenic amino acid side chain; R4 is —OH or —O—R5 wherein R5 is linear or branched C1-C6 lower alkyl; and each R6 is independently H or —CH3; or a pharmaceutically acceptable prodrug, salt, or ester thereof. Compositions containing said compounds, and uses thereof, are also provided.

  本文提供了式 I 的化合物，其中 R1 是 H 或直链或支链 C1-C6 低级烷基；R2 是 H、直链或支链 C1-C6 低级烷基或蛋白氨基酸侧链；R3 是 H、直链或支链 C1-C6 低级烷基或蛋白氨基酸侧链；R4 是 -OH 或 -O-R5 其中 R5 是直链或支链 C1-C6 低级烷基；每个 R6 独立地是 H 或 -CH3；或其药学上可接受的原药、盐或酯。还提供了含有所述化合物的组合物及其用途。
• CYSTARGOLIDE COMPOUNDS AND USES THEREOF
  申请人：UNIVERSITY OF PRINCE EDWARD ISLAND

  公开号：US20180155392A1

  公开（公告）日：2018-06-07

  There is provided herein compounds of formula I, wherein R 1 is H or linear or branched C 1 -C 6 lower alkyl; R 2 is H, linear or branched C 1 -C 6 lower alkyl, or a proteinogenic amino acid side chain; R 3 is H, linear or branched C 1 -C 6 lower alkyl, or a proteinogenic amino acid side chain; R 4 is ——OH or —O—R 5 wherein R 5 is linear or branched C 1 -C 6 lower alkyl; and each R 6 is independently H or —CH 3 ; or a pharmaceutically acceptable prodrug, salt, or ester thereof. Compositions containing said compounds, and uses thereof, are also provided.