5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(aminocarbonyl)oxy]methyl]-7-[[(2E)-2-(2-furanyl)-2-(methoxyimino)acetyl]amino]-8-oxo-, 1-(acetyloxy)ethyl ester, (6R,7R) structure
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Common Name | 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(aminocarbonyl)oxy]methyl]-7-[[(2E)-2-(2-furanyl)-2-(methoxyimino)acetyl]amino]-8-oxo-, 1-(acetyloxy)ethyl ester, (6R,7R) | ||
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| CAS Number | 97232-96-7 | Molecular Weight | 510.47400 | |
| Density | 1.61±0.1 g/cm3(20 °C , 760mmHg) | Boiling Point | N/A | |
| Molecular Formula | C20H22N4O10S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(aminocarbonyl)oxy]methyl]-7-[[(2E)-2-(2-furanyl)-2-(methoxyimino)acetyl]amino]-8-oxo-, 1-(acetyloxy)ethyl ester, (6R,7R) |
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| Synonym | More Synonyms |
| Density | 1.61±0.1 g/cm3(20 °C , 760mmHg) |
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| Molecular Formula | C20H22N4O10S |
| Molecular Weight | 510.47400 |
| Exact Mass | 510.10600 |
| PSA | 214.36000 |
| LogP | 0.86080 |
| InChIKey | KEJCWVGMRLCZQQ-DJMWJSSGSA-N |
| SMILES | CON=C(C(=O)NC1C(=O)N2C(C(=O)OC(C)OC(C)=O)=C(COC(N)=O)CSC12)c1ccco1 |
| RIDADR | NONH for all modes of transport |
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| Precursor 0 | |
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| DownStream 1 | |
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Name: ERK5 transcriptional activity HTS
Source: 24565
Target: N/A
External Id: ERK5 transcriptional activity-HTS
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Name: Primary qHTS for inhibitors of NSP2Pro chikungunya virus (CHIKV)
Source: NCGC
External Id: APP-Toga-CHIKV-nsp2-p
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Name: Biochemical firefly luciferase enzyme assay for NPC
Source: NCGC
Target: Luciferase [Photinus pyralis]
External Id: adst-fluc-km-fda-o1_regid
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Name: Primary qHTS for Vero E6 cytotoxicity: counterscreen for inhibitors of SARS-S pseudo-...
Source: NCGC
Target: N/A
External Id: TRND-SARS-cytotox-48hr-p1-npc
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Name: Primary qHTS Assay for Inhibitors of Recombinant Selenoprotein Glutathione Peroxidase...
Source: NCGC
External Id: GPx1-biochemical-p4-p7
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Name: Primary qHTS for inhibitors of MERS-S pseudo-typed particle cell entry
Source: NCGC
Target: N/A
External Id: TRND-MERS-PP-p1-npc
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Name: Cytotoxicity counterscreen for inhibitors of SARS-CoV-2 cell entry
Source: NCGC
Target: N/A
External Id: TRND-SARS-CoV-2-cytotox-48hr
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Name: Primary qHTS for Huh7 cytotoxicity: counterscreen for inhibitors of MERS-S pseudotype...
Source: NCGC
Target: N/A
External Id: TRND-MERS-cytotox-48hr-p1-npc
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Name: Primary qHTS to identify inhibitors of SARS-CoV-2 cell entry
Source: NCGC
External Id: TRND-SARS-CoV-2-PP
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Name: Primary qHTS for inhibitors of SARS-S pseudo-typed particle cell entry
Source: NCGC
External Id: TRND-SARS-PP-p1-npc
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| (E)-Cefuroxime Axetil |
| 1-acetyloxyethyl (6R,7R)-3-(carbamoyloxymethyl)-7-[[(2E)-2-(furan-2-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |
| (E)-Cefuroxime Axetil |
| 1-acetyloxyethyl (6R,7R)-3-(carbamoyloxymethyl)-7-[[(2E)-2-(furan-2-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |