异喹啉-3-甲酸结构式
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常用名 | 异喹啉-3-甲酸 | 英文名 | Isoquinoline-3-carboxylic acid |
|---|---|---|---|---|
| CAS号 | 6624-49-3 | 分子量 | 173.168 | |
| 密度 | 1.3±0.1 g/cm3 | 沸点 | 366.4±17.0 °C at 760 mmHg | |
| 分子式 | C10H7NO2 | 熔点 | 166-167ºC | |
| MSDS | 中文版 美版 | 闪点 | 175.4±20.9 °C |
| 中文名 | 异喹啉-3-甲酸 |
|---|---|
| 英文名 | Isoquinoline-3-carboxylic acid |
| 中文别名 | 3-羧酸异喹啉 |
| 英文别名 | 更多 |
| 密度 | 1.3±0.1 g/cm3 |
|---|---|
| 沸点 | 366.4±17.0 °C at 760 mmHg |
| 熔点 | 166-167ºC |
| 分子式 | C10H7NO2 |
| 分子量 | 173.168 |
| 闪点 | 175.4±20.9 °C |
| 精确质量 | 173.047684 |
| PSA | 50.19000 |
| LogP | 1.13 |
| InChIKey | KVMMIDQDXZOPAB-UHFFFAOYSA-N |
| SMILES | O=C(O)c1cc2ccccc2cn1 |
| 蒸汽压 | 0.0±0.9 mmHg at 25°C |
| 折射率 | 1.685 |
| 储存条件 | 室温 |
| 危害码 (欧洲) | Xi: Irritant;Xi: Irritant; |
|---|---|
| 风险声明 (欧洲) | R36/37/38 |
| 安全声明 (欧洲) | 26-37/39 |
| 海关编码 | 2933499090 |
| 海关编码 | 2933499090 |
|---|---|
| 中文概述 | 2933499090. 其他含喹琳或异喹啉环系的化合物〔但未进一步稠合的〕. 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 | 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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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: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: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
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实验名称:Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
来源:Broad Institute
靶标:N/A
External Id:7124-01_Inhibitor_SinglePoint_HTS_Activity
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实验名称:Antitumor activity against mouse S180 cells xenografted in ICR mouse assessed as tumo...
来源:ChEMBL
靶标:CCRF S-180
External Id:CHEMBL1772302
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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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实验名称:uHTS identification of small molecule modulators of NR3A
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:SBCCG-A1015-NR3A-Primary-Assay
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| 3-Isoquinolinecarboxylic acid |
| MFCD00075137 |
| Isoquinoline-3-carboxylic acid |