1-苄基-5-氧代-3-吡咯烷甲酸结构式
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常用名 | 1-苄基-5-氧代-3-吡咯烷甲酸 | 英文名 | 1-Benzyl-2-oxopyrrolidine-4-carboxylic acid |
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| CAS号 | 5733-86-8 | 分子量 | 219.236 | |
| 密度 | 1.3±0.1 g/cm3 | 沸点 | 471.3±45.0 °C at 760 mmHg | |
| 分子式 | C12H13NO3 | 熔点 | 144 °C | |
| MSDS | N/A | 闪点 | 238.8±28.7 °C |
| 中文名 | 1-苄基-5-氧代-3-吡咯烷甲酸 |
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| 英文名 | 1-Benzyl-5-oxo-3-pyrrolidinecarboxylic Acid |
| 中文别名 | 1-苄基-5-氧代-吡咯啉-3-甲酸 | 1-苯基-4-羧基-2-吡咯烷酮 | 1-苯基-5-氧代吡咯烷-3-甲酸 |
| 英文别名 | 更多 |
| 密度 | 1.3±0.1 g/cm3 |
|---|---|
| 沸点 | 471.3±45.0 °C at 760 mmHg |
| 熔点 | 144 °C |
| 分子式 | C12H13NO3 |
| 分子量 | 219.236 |
| 闪点 | 238.8±28.7 °C |
| 精确质量 | 219.089539 |
| PSA | 57.61000 |
| LogP | 0.64 |
| InChIKey | VYKQDWPBYULGPF-UHFFFAOYSA-N |
| SMILES | O=C(O)C1CC(=O)N(Cc2ccccc2)C1 |
| 外观性状 | 固体;White to Almost white powder to crystal |
| 蒸汽压 | 0.0±1.2 mmHg at 25°C |
| 折射率 | 1.604 |
| 储存条件 | 室温,干燥 |
| 危害码 (欧洲) | Xi |
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| 海关编码 | 2933790090 |
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1-苄基-5-氧代-3-吡咯烷甲酸 5733-86-8 |
| 文献:Sumitomo Pharmaceuticals Company, Limited Patent: EP1403255 A1, 2004 ; Location in patent: Page 78 ; EP 1403255 A1 |
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1-苄基-5-氧代-3-吡咯烷甲酸 5733-86-8 |
| 文献:Gallagher, Timothy; Derrick, Ian; Durkin, Patrick M.; Haseler, Claire A.; Hirschhaeuser, Christoph; Magrone, Pietro Journal of Organic Chemistry, 2010 , vol. 75, # 11 p. 3766 - 3774 |
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1-苄基-5-氧代-3-吡咯烷甲酸 5733-86-8 |
| 文献:US6436954 B1, ; |
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1-苄基-5-氧代-3-吡咯烷甲酸 5733-86-8 |
| 文献:European Journal of Organic Chemistry, , # 4 p. 673 - 682 |
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1-苄基-5-氧代-3-吡咯烷甲酸 5733-86-8 |
| 文献:European Journal of Organic Chemistry, , # 4 p. 673 - 682 |
| 海关编码 | 2933790090 |
|---|---|
| 中文概述 | 2933790090 其他内酰胺. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:9.0% 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 | 2933790090. other lactams. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:9.0%. General tariff:20.0% |
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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
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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
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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
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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
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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
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实验名称:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
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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.
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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
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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实验名称:Fluorescence polarization-based biochemical high throughput primary assay to identify...
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id:SIAE_INH_FP_1536_1X%INH PRUN
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| 1-benzyl-5-oxopyrrolidine-3-carboxylic acid |
| 1-Benzyl-5-oxo-3-pyrrolidinecarboxylic acid |
| 1-Benzyl-2-oxopyrrolidine-4-carboxylic acid |
| MFCD00085749 |