ethyl 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate结构式
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常用名 | ethyl 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate | 英文名 | ethyl 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate |
|---|---|---|---|---|
| CAS号 | 21660-16-2 | 分子量 | 243.30100 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C15H17NO2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。
| 英文名 | ethyl 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate |
|---|---|
| 英文别名 | 更多 |
本表包含该物质理化参数,如熔点、沸点、密度、溶解度、旋光性等理化指标,无数据项标记为N/A。
| 分子式 | C15H17NO2 |
|---|---|
| 分子量 | 243.30100 |
| 精确质量 | 243.12600 |
| PSA | 42.09000 |
| LogP | 3.22340 |
| InChIKey | MCTFKFAJCCQSRS-UHFFFAOYSA-N |
| SMILES | CCOC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 |
本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。
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~90%
ethyl 6,7,8,9-t... 21660-16-2 |
| 文献:Alekseeva; Bokanov; Granik Pharmaceutical Chemistry Journal, 2002 , vol. 36, # 6 p. 318 - 323 |
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~%
ethyl 6,7,8,9-t... 21660-16-2 |
| 文献:Shaw; Woolley Journal of the American Chemical Society, 1957 , vol. 79, p. 3561,3562 |
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~%
ethyl 6,7,8,9-t... 21660-16-2 |
| 文献:Haag, Benjamin A.; Zhang, Zhi-Guang; Li, Jin-Shan; Knochel, Paul Angewandte Chemie - International Edition, 2010 , vol. 49, # 49 p. 9513 - 9516 |
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~43%
ethyl 6,7,8,9-t... 21660-16-2 |
| 文献:Wang, Wenya; Dong, Guoqiang; Gu, Julin; Zhang, Yongqiang; Wang, Shengzheng; Zhu, Shiping; Liu, Yang; Miao, Zhenyuan; Yao, Jianzhong; Zhang, Wannian; Sheng, Chunquan MedChemComm, 2013 , vol. 4, # 2 p. 353 - 362 |
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~%
ethyl 6,7,8,9-t... 21660-16-2 |
| 文献:Wang, Wenya; Dong, Guoqiang; Gu, Julin; Zhang, Yongqiang; Wang, Shengzheng; Zhu, Shiping; Liu, Yang; Miao, Zhenyuan; Yao, Jianzhong; Zhang, Wannian; Sheng, Chunquan MedChemComm, 2013 , vol. 4, # 2 p. 353 - 362 |
本表列出该化学品对应的上游起始原料以及下游衍生产物清单。
| 上游产品 7 | |
|---|---|
| 下游产品 1 | |
本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。
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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: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:Dicer-mediated maturation of pre-microRNA
来源:Center for Chemical Genomics, University of Michigan
靶标:N/A
External Id:TargetID_659_CEMA
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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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本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。
| 1,2,3,4-tetrahydrocarbazole-6-carboxylic acid ethyl ester |
| 5,6,7,8-tetrahydro-carbazole-3-carboxylic acid ethyl ester |
| 5,6,7,8-tetrahydro-9H-carbazole-3-carboxylic acid ethyl ester |
| 6,7,8,9-Tetrahydro-5H-carbazole-3-carboxylic acid ethyl ester |
| 1,2,3,4-Tetrahydrocarbazol-6-carbonsaeureethylester |
| 6-Carbethoxy-1,2,3,4-tetrahydrocarbazol |
| 5,6,7,8-Tetrahydro-carbazol-3-carbonsaeure-aethylester |
| ethyl 2,3,4,9-tetrahydro-1H-carbazole-6-carboxylate |
本部分为该化合物相关常见问答,包含基础参数、性状、储存条件等高频咨询问题与对应答案。
| Q: 21660-16-2的极性表面积PSA是多少? |
| A: 21660-16-2极性表面积PSA为42.09000。 |
| Q: 21660-16-2的SMILES表达式是什么? |
| A: 21660-16-2SMILES表达式为CCOC(=O)c1ccc2[nH]c3c(c2c1)CCCC3。 |
| Q: 21660-16-2的分子量是多少? |
| A: 21660-16-2分子量为243.30100。 |
| Q: 21660-16-2的下游产品有哪些? |
| A: 21660-16-2相关下游产品(CAS):51035-17-7。 |
| Q: 21660-16-2的分子式是什么? |
| A: 21660-16-2分子式为C15H17NO2。 |
| Q: 21660-16-2有哪些英文别名? |
| A: 21660-16-2英文别名有:1,2,3,4-tetrahydrocarbazole-6-carboxylic acid ethyl ester、 5,6,7,8-tetrahydro-carbazole-3-carboxylic acid ethyl ester、 5,6,7,8-tetrahydro-9H-carbazole-3-carboxylic acid ethyl ester、 6,7,8,9-Tetrahydro-5H-carbazole-3-carboxylic acid ethyl ester、 1,2,3,4-Tetrahydrocarbazol-6-carbonsaeureethylester、 6-Carbethoxy-1,2,3,4-tetrahydrocarbazol、 5,6,7,8-Tetrahydro-carbazol-3-carbonsaeure-aethylester、 ethyl 2,3,4,9-tetrahydro-1H-carbazole-6-carboxylate。 |
| Q: 21660-16-2的中文名称是什么? |
| A: 21660-16-2的中文名称为21660-16-2。 |
| Q: 21660-16-2的LogP(油水分配系数)是多少? |
| A: 21660-16-2LogP(油水分配系数)为3.22340。 |
| Q: 21660-16-2的上游原料有哪些? |
| A: 21660-16-2相关上游原料(CAS):64-17-5;36729-27-8;108-85-0;348-06-1;1056477-06-5;94-09-7;108-94-1。 |
| Q: 21660-16-2的InChIKey是什么? |
| A: 21660-16-2InChIKey为MCTFKFAJCCQSRS-UHFFFAOYSA-N。 |