3H-苯并[e]吲哚-2-羧酸结构式
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常用名 | 3H-苯并[e]吲哚-2-羧酸 | 英文名 | 3H-Benz[e]indole-2-carboxylic acid |
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| CAS号 | 50536-72-6 | 分子量 | 211.21600 | |
| 密度 | 1.422g/cm3 | 沸点 | 513.7ºC at 760 mmHg | |
| 分子式 | C13H9NO2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 264.5ºC |
| 中文名 | 3H-苯并[e]吲哚-2-羧酸 |
|---|---|
| 英文名 | 3H-Benzo[e]indole-2-carboxylic acid |
| 英文别名 | 更多 |
| 密度 | 1.422g/cm3 |
|---|---|
| 沸点 | 513.7ºC at 760 mmHg |
| 分子式 | C13H9NO2 |
| 分子量 | 211.21600 |
| 闪点 | 264.5ºC |
| 精确质量 | 211.06300 |
| PSA | 53.09000 |
| LogP | 3.01930 |
| InChIKey | PZHFTOALJLZERX-UHFFFAOYSA-N |
| SMILES | O=C(O)c1cc2c(ccc3ccccc32)[nH]1 |
| 折射率 | 1.796 |
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~69%
3H-苯并[e]吲哚-2-羧酸 50536-72-6 |
| 文献:The Scripps Research Institute Patent: US2005/26987 A1, 2005 ; Location in patent: Page 31 ; |
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3H-苯并[e]吲哚-2-羧酸 50536-72-6 |
| 文献:The Upjohn Company Patent: US5489593 A1, 1996 ; |
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3H-苯并[e]吲哚-2-羧酸 50536-72-6 |
| 文献:SCHERING CORPORATION Patent: WO2008/82488 A1, 2008 ; Location in patent: Page/Page column 129 ; |
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3H-苯并[e]吲哚-2-羧酸 50536-72-6 |
| 文献:Miller, Thomas A.; Vachaspati, Prakash R.; Labroli, Marc A.; Thompson, Charles D.; Bulman, Amanda L.; Macdonald, Timothy L. Bioorganic and Medicinal Chemistry Letters, 1998 , vol. 8, # 9 p. 1065 - 1070 |
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3H-苯并[e]吲哚-2-羧酸 50536-72-6 |
| 文献:Schlieper Justus Liebigs Annalen der Chemie, 1886 , vol. 236, p. 177 |
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3H-苯并[e]吲哚-2-羧酸 50536-72-6 |
| 文献:Beugelmans, Rene; Chbani, Mohamed Bulletin de la Societe Chimique de France, 1995 , vol. 132, # 7 p. 729 - 733 |
| 3H-苯并[e]吲哚-2-羧酸上游产品 3 | |
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| 3H-苯并[e]吲哚-2-羧酸下游产品 1 | |
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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: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: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: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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| 3H-Benz[e]indol-2-carbonsaeure |
| benz[e]indole-2-carboxylic acid |
| 3H-benz[e]indole-2-carboxylic acid |