1H-Pyrrole-2,4-dicarboxylic acid, 5- (hydroxymethyl)-3-methyl-, diethyl ester

• 常用名: 1H-Pyrrole-2,4-dicarboxylic acid, 5- (hydroxymethyl)-3-methyl-, diethyl ester
• 英文名: 1H-Pyrrole-2,4-dicarboxylic acid, 5- (hydroxymethyl)-3-methyl-, diethyl ester
• CAS号: 5422-89-9
• 分子量: 255.26700
• 密度: 1.235g/cm3
• 沸点: 460.1ºC at 760 mmHg
• 分子式: C₁₂H₁₇NO₅
• 熔点: N/A
• 闪点: 232.1ºC

名称

• 英文名: diethyl 5-(hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate

物理化学性质

• 密度: 1.235g/cm3
• 沸点: 460.1ºC at 760 mmHg
• 分子式: C₁₂H₁₇NO₅
• 分子量: 255.26700
• 闪点: 232.1ºC
• 精确质量: 255.11100
• PSA: 88.62000
• LogP: 1.16880
• InChIKey: MJDIWVWPQXHGAJ-UHFFFAOYSA-N
• SMILES: CCOC(=O)c1[nH]c(CO)c(C(=O)OCC)c1C
• 折射率: 1.539

安全信息

• 海关编码: 2933990090

海关

• 海关编码: 2933990090
• 中文概述: 2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
• 申报要素: 品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期
• Summary: 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

靶点实验

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实验名称：Primary cell-based high-throughput screening assay for identification of compounds th... 来源：Johns Hopkins Ion Channel Center 靶标：regulator of G-protein signaling 4 isoform 2 [Homo sapiens] External Id：JHICC_RGS_Act_HTS

实验名称：Luminescence-based cell-based primary high throughput screening assay to identify ago... 来源：The Scripps Research Institute Molecular Screening Center 靶标：mu-type opioid receptor isoform MOR-1 [Homo sapiens] External Id：OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN

实验名称：QFRET-based biochemical primary high throughput screening assay to identify exosite i... 来源：The Scripps Research Institute Molecular Screening Center 靶标：disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens] External Id：ADAM17_INH_QFRET_1536_1X%INH PRUN

实验名称：Fluorescence-based cell-based primary high throughput screening assay to identify ago... 来源：The Scripps Research Institute Molecular Screening Center 靶标：muscarinic acetylcholine receptor M1 [Homo sapiens] External Id：CHRM1_AG_FLUO8_1536_1X%ACT PRUN

实验名称：uHTS identification of small molecule activators of the adaptive arm of the Unfolded ... 来源：Burnham Center for Chemical Genomics 靶标：N/A External Id：BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay

实验名称：Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ... 来源：ChEMBL 靶标：Klebsiella pneumoniae External Id：CHEMBL4296186

实验名称：High throughput fluorescence intensity-based biochemical assay to screen for small mo... 来源：University of Pittsburgh Molecular Library Screening Center 靶标：furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens] External Id：MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.

实验名称：Fluorescence polarization to screen for inhibitor that competite the binding of FadD2... 来源：Broad Institute 靶标：FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE) External Id：2147-01_Inhibitor_SinglePoint_HTS_Activity

实验名称：Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect... 来源：Broad Institute 靶标：N/A External Id：Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity

实验名称：Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay 来源：24386 靶标：N/A External Id：Sarm1 TIR NADase inhibitors

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英文别名

• 5-(Hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylicacid diethyl ester
• Pyrrole Analogue 3
• 3,5-bisethoxycarbonyl-2-hydroxymethyl-4-methylpyrrole
• HMS2885B13
• 5-Hydroxymethyl-3-methyl-pyrrol-2,4-dicarbonsaeure-diaethylester
• 5-hydroxymethyl-3-methyl-pyrrole-2,4-dicarboxylic acid diethyl ester