4'-Acetylbenzo-18-crown 6-Ether structure
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Common Name | 4'-Acetylbenzo-18-crown 6-Ether | ||
|---|---|---|---|---|
| CAS Number | 41855-35-0 | Molecular Weight | 354.395 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 527.7±50.0 °C at 760 mmHg | |
| Molecular Formula | C18H26O7 | Melting Point | 77-78ºC | |
| MSDS | N/A | Flash Point | 231.6±30.2 °C | |
| Name | 4'-Acetylbenzo-18-crown 6-Ether |
|---|---|
| Synonym | More Synonyms |
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 527.7±50.0 °C at 760 mmHg |
| Melting Point | 77-78ºC |
| Molecular Formula | C18H26O7 |
| Molecular Weight | 354.395 |
| Flash Point | 231.6±30.2 °C |
| Exact Mass | 354.167847 |
| PSA | 72.45000 |
| LogP | 0.38 |
| Vapour Pressure | 0.0±1.4 mmHg at 25°C |
| Index of Refraction | 1.465 |
| InChIKey | GOVDFSVHYMATAJ-UHFFFAOYSA-N |
| SMILES | CC(=O)c1ccc2c(c1)OCCOCCOCCOCCOCCO2 |
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~88%
4'-Acetylbenzo-... CAS#:41855-35-0 |
| Literature: Shkinev, A. V.; Asrarov, M. I.; Gagel'gans, A. I.; Saifullina, N. Zh.; Mukhamedzhanova, E. A.; Tashmukhamedova, A. K. Chemistry of Natural Compounds, 1983 , vol. 19, # 5 p. 597 - 600 Khimiya Prirodnykh Soedinenii, 1983 , # 5 p. 634 - 637 |
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~75%
4'-Acetylbenzo-... CAS#:41855-35-0 |
| Literature: Talma, Auke G.; Vossen, Huib van; Sudhoelter, Ernst J. R.; Eerden, Johan van; Reinhoudt, David N. Synthesis, 1986 , # 8 p. 680 - 683 |
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~%
4'-Acetylbenzo-... CAS#:41855-35-0 |
| Literature: Arias; Echegoyen; Wilson; Lu Journal of the American Chemical Society, 1995 , vol. 117, # 4 p. 1422 - 1427 |
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~85%
4'-Acetylbenzo-... CAS#:41855-35-0 |
| Literature: Sharghi, Hashem; Jokar, Mahboubeh; Doroodmand, Mohammad Mahdi; Khalifeh, Reza Advanced Synthesis and Catalysis, 2010 , vol. 352, # 17 p. 3031 - 3044 |
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~%
4'-Acetylbenzo-... CAS#:41855-35-0 |
| Literature: Alonso, Maria Teresa; Brunet, Ernesto; Hernandez, Concepcion; Rodriguez-Ubis, Juan Carlos Tetrahedron Letters, 1993 , vol. 34, # 46 p. 7465 - 7468 |
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~48%
4'-Acetylbenzo-... CAS#:41855-35-0 |
| Literature: Fenton, David E.; Parkin, Donald; Newton, Roger F. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1981 , p. 449 - 454 |
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~%
4'-Acetylbenzo-... CAS#:41855-35-0 |
| Literature: Talma, Auke G.; Vossen, Huib van; Sudhoelter, Ernst J. R.; Eerden, Johan van; Reinhoudt, David N. Synthesis, 1986 , # 8 p. 680 - 683 |
|
~%
4'-Acetylbenzo-... CAS#:41855-35-0 |
| Literature: Talma, Auke G.; Vossen, Huib van; Sudhoelter, Ernst J. R.; Eerden, Johan van; Reinhoudt, David N. Synthesis, 1986 , # 8 p. 680 - 683 |
|
~%
4'-Acetylbenzo-... CAS#:41855-35-0 |
| Literature: Fenton, David E.; Parkin, Donald; Newton, Roger F. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1981 , p. 449 - 454 |
| Precursor 10 | |
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| DownStream 1 | |
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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|
Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: 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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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: 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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Name: qHTS of TDP-43 Inhibitors: NCGC Sytravon Library Screen
Source: NCGC
External Id: tdp43-p2-repeat
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|
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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|
Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: 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-(2,3,5,6,8,9,11,12,14,15-Decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin-18-yl)ethanone |
| 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)ethanone |
| 2,3-(4-Acetylbenzo)-1,4,7,10,13,16-hexaoxacyclooctadec-2-ene |