CAS: 863971-24-8; 6-(2,5-Dioxo-2,5-Dihydro-1H-Pyrrol-1-yl)-N-((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-Hydroxy-1-Phenylpropan-2-yl)Amino)-1-Methoxy-2-Methyl-3-Oxopropyl)Pyrrolidin-1-yl)-3-Methoxy-5-Methyl-1-Oxoheptan-4-yl)(Methyl)Amino)-3-Methyl-1-Oxobuta

该化合物是一种化学化合物,具有独特的硫化物和丙酰胺功能组的特点,主要因其在医药化学领域的潜在应用而得到承认,特别是在药品开发方面;该化合物具有硫化物环的特点,因其生物活动而闻名,以及可影响其溶性和再活动的一个甲基硫基组的特点;McMMAE可能表现出中度至高脂度的特性,从而影响其在生物系统中的吸收和分布;此外,多芳香环的存在表明,有可能发生欧元堆叠相互作用,这在药物受体的结合中意义重大;与许多合成化合物一样,了解其稳定性,再活性和与生物目标的相互作用对于评估其在研究和治疗应用中的效用至关重要;安全数据和处理预防措施,与任何化学物质一样,应当与任何化学物质一起,确保适当的实验室做法.

英文名称6-(2,5-Dioxo-2,5-Dihydro-1H-Pyrrol-1-yl)-N-((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-Hydroxy-1-Phenylpropan-2-yl)Amino)-1-Methoxy-2-Methyl-3-Oxopropyl)Pyrrolidin-1-yl)-3-Methoxy-5-Methyl-1-Oxoheptan-4-yl)(Methyl)Amino)-3-Methyl-1-Oxobuta
中文名称马来酰亚胺基己酰-单甲基澳瑞他汀 E
IUPAC名称6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)(methyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)-N-methylhexanamide
其它别名Mc Mmae; Mcmmae; Mc-Mmae; Maleimidocaproyl-Monomethylauristatin E; L-Valinamide, N-[6-(2,5-Dihydro-2,5-Dioxo-1H-Pyrrol-1-yl)-1-Oxohexyl]-N-Methyl-L-Valyl-N-[(1S,2R)-4-[(2S)-2-[(1R,2R)-3-[[(1R,2S)-2-Hydroxy-1-Methyl-2-Phenylethyl]Amino]-1-Methoxy-2-Methyl-3-Oxopropyl]-1-Pyrrolidinyl]-2-Methoxy-1-[(1S)-1-Methylpropyl]-4-Oxobutyl]-N-Methyl-; Mc-Mmae,Inhibitor,Drug-Linker Conjugates For Adc,Mcmmae,Microtubule/tubulin,Mc Mmae,Inhibit; 6-(2,5-Dioxo-2,5-Dihydro-1H-Pyrrol-1-yl)-N-((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-Hydroxy-1-Phenylpropan-2-yl)Amino)-1-Methoxy-2-Methyl-3-Oxopropyl)Pyrrolidin-1-yl)-3-Methoxy-5-Methyl-1-Oxoheptan-4-yl)(Methyl)Amino)-3-Methyl-1-Oxobutan-2-yl)Amino)-3-Methyl-1-Oxobutan-2-yl)-N-Methylhexanamide
CAS编号863971-24-8
MFCD编号:MFCD28167757
分子式:C49H78N6O10分子量:911.2
产品CID: 1865392
产品分类Inhibitors/Agonists → Cell Cycle → Microtubule/Tubulin | ADCs → ADC Linker with Payload | Inhibitors/Agonists → Cell Cycle → Microtubule/Tubulin

相似结构搜索
InChIKey: UGJOTJHSQWBROP-AXJCKIDNSA-N
MMUKUGXLBJUPND-AXJCKIDNSA-N
计算化学: 氢键受体数16.0氢键供体数3.0可旋转键数31.0

MSDS等安全信息

警示词Warning
危险描述H302-H315-H319-
防范说明P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P337+P313-P362+P364-P501-

上下游产品

2,5-Dihydro-2,5-dioxo-1H-pyrrole-1-hexanoic acid [3H]-Vedotin 6-aminohexanoic acid

合成工艺路线路线简述

合成目标产物 Mcmmae 主要起始原料 6-Maleimidocaproic Acid And Monomethyl Auristatin E
55750-53-3 + 474645-27-7 = 863971-24-8
反应条件:1.1 Reagents: Diethyl Cyanophosphonate,Diisopropylethylamine Solvents: Dichloromethane; 2 H,Rt
标题:Enhanced Activity Of Monomethylauristatin F Through Monoclonal Antibody Delivery: Effects Of Linker Technology On Efficacy And Toxicity
作者:Doronina,Svetlana O.; Et Al
参考文献:Bioconjugate Chemistry 日期:2006 卷标:17(1) 页码:114-124

其他信息查阅

供应商参考报价(招募中)

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实用工具

📌 第三方产品分析报告

✅ COA系统入驻 | 共享模式

主要参考文献

1: Chon H, Kanamori S, Hibino K, Nagahara T, Suzuki T, Ohara K, Narumi H. ez- ADiCon: A novel glyco-remodeling based strategy that enables preparation of homogenous antibody-drug conjugates via one-step enzymatic transglycosylation with payload-preloaded bi-antennary glycan complexes. Bioorg Med Chem Lett. 2022 Dec 27;80:129117. doi: 10.1016/j.bmcl.2022.129117. Epub ahead of print. 22(1):417. doi: 10.1186/s12935-022-02839-w.
3: Hoffman-Censits J, Maldonado L. Targeted Treatment of Locally Advanced and Metastatic Urothelial Cancer: Enfortumab Vedotin in Context. Onco Targets Ther. 2022 Dec 15;15:1519-1529. doi: 10.2147/OTT.S370900.
4: Paulus J, Nachtigall B, Meyer P, Sewald N. RGD Peptidomimetic MMAE-Conjugate Addressing Integrin αVβ3-Expressing Cells with High Targeting Index*. Chemistry. 2022 Dec 1. doi: 10.1002/chem.202203476. Epub ahead of print. 15(1):2149057. doi: 10.1080/19420862.2022.2149057. 14(10):2131. doi: 10.3390/pharmaceutics14102131.