AC-FLTD-CMK
| 中文名称 | AC-FLTD-CMK |
|---|---|
| 中文同义词 | 化合物AC-FLTD-CMK;(4S,7S,10S,13S)-4-苄基-13-(2-氯乙酰基)-10-((R)-1-羟乙基)-7-异丁基-2,5,8,11-四氧代-3,6,9,12-四氮杂十五烷-15-酸 |
| 英文名称 | (4S,7S,10S,13S)-4-Benzyl-13-(2-chloroacetyl)-10-((R)-1-hydroxyethyl)-7-isobutyl-2,5,8,11-tetraoxo-3,6,9,12-tetraazapentadecan-15-oic acid |
| 英文同义词 | (4S,7S,10S,13S)-4-Benzyl-13-(2-chloroacetyl)-10-((R)-1-hydroxyethyl)-7-isobutyl-2,5,8,11-tetraoxo-3,6,9,12-tetraazapentadecan-15-oic acid |
| CAS号 | 2376255-48-8 |
| 分子式 | C26H37ClN4O8 |
| 分子量 | 569.05 |
| EINECS号 | |
| 相关类别 | |
| Mol文件 | 2376255-48-8.mol |
| 结构式 |  |
AC-FLTD-CMK 性质
| 沸点 | 962.7±65.0 °C(Predicted) |
|---|---|
| 密度 | 1.275±0.06 g/cm3(Predicted) |
| 储存条件 | Store at -20°C, protect from light, stored under nitrogen |
| 溶解度 | 在 DMSO 中的溶解度为 1 mg/ml |
| 酸度系数(pKa) | 3.93±0.19(Predicted) |
| 形态 | 固体 |
| 颜色 | 白色至米白色 |
| InChIKey | UCWNTWGHVCSMJP-AIPSELJTNA-N |
| SMILES | [C@@H](CC(C)C)(NC(=O)[C@@H](NC(=O)C)CC1C=CC=CC=1)C(=O)N[C@@H]([C@H](O)C)C(=O)N[C@@H](CC(=O)O)C(=O)CCl |&1:0,8,23,24,30,r| |
|
Caspase-1 46.7 nM (IC 50 ) |
Caspase-4 1.49 μM (IC 50 ) |
Caspase-5 329 nM (IC 50 ) |
Caspase-11
|
Ac-FLTD-CMK, inhibits GSDMD cleavage by caspases-1, -4, -5, and -11 in vitro, suppresses pyroptosis downstream of both canonical and noncanonical inflammasomes, as well as reduces IL-1β release following activation of the NLRP3 inflammasome in macrophages. By contrast, Ac-FLTD-CMK does not target caspase-3 or apoptotic cell death. Crystal structure of caspase-1 in complex with Ac-FLTD-CMK reveals extensive enzyme-inhibitor interactions involving both hydrogen bonds and hydrophobic contacts.
安全信息
| WGK Germany | WGK 3 |
|---|---|
| 存储类别 | 11 - 可燃固体 |