2(R)-ACETYLTHIO-BENZENEPROPANOIC ACID
2(R)-ACETYLTHIO-BENZENEPROPANOIC ACID structure
|
Common Name | 2(R)-ACETYLTHIO-BENZENEPROPANOIC ACID | ||
|---|---|---|---|---|
| CAS Number | 57359-76-9 | Molecular Weight | 224.27600 | |
| Density | 1.261g/cm3 | Boiling Point | 358.93ºC at 760 mmHg | |
| Molecular Formula | C11H12O3S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 170.875ºC | |
| Name | (2R)-2-acetylsulfanyl-3-phenylpropanoic acid |
|---|---|
| Synonym | More Synonyms |
| Density | 1.261g/cm3 |
|---|---|
| Boiling Point | 358.93ºC at 760 mmHg |
| Molecular Formula | C11H12O3S |
| Molecular Weight | 224.27600 |
| Flash Point | 170.875ºC |
| Exact Mass | 224.05100 |
| PSA | 79.67000 |
| LogP | 1.96200 |
| Index of Refraction | 1.581 |
| InChIKey | UOVSNFYJYANSNI-SNVBAGLBSA-N |
| SMILES | CC(=O)SC(Cc1ccccc1)C(=O)O |
|
~94%
2(R)-ACETYLTHIO... CAS#:57359-76-9 |
| Literature: BIOMEP INC. Patent: WO2004/50620 A2, 2004 ; Location in patent: Page 38-39 ; |
|
~10%
2(R)-ACETYLTHIO... CAS#:57359-76-9 |
| Literature: Coric, Pascale; Turcaud, Serge; Meudal, Herve; Roques, Bernard Pierre; Fournie-Zaluski, Marie-Claude Journal of Medicinal Chemistry, 1996 , vol. 39, # 6 p. 1210 - 1219 |
|
~91%
2(R)-ACETYLTHIO... CAS#:57359-76-9 |
| Literature: Spaltenstein; Leban; Furfine Tetrahedron Letters, 1993 , vol. 34, # 9 p. 1457 - 1460 |
|
~44%
2(R)-ACETYLTHIO... CAS#:57359-76-9 |
| Literature: Strijtveen, Bert; Kellog, Richard M. Recueil des Travaux Chimiques des Pays-Bas, 1987 , vol. 106, # 10 p. 539 - 542 |
|
~%
2(R)-ACETYLTHIO... CAS#:57359-76-9 |
| Literature: Journal of Medicinal Chemistry, , vol. 39, # 6 p. 1210 - 1219 |
|
~%
2(R)-ACETYLTHIO... CAS#:57359-76-9 |
| Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 9, # 17 p. 2549 - 2554 |
|
~%
2(R)-ACETYLTHIO... CAS#:57359-76-9 |
| Literature: Bioorganic and Medicinal Chemistry, , vol. 12, # 11 p. 2853 - 2861 |
| Precursor 9 | |
|---|---|
| DownStream 0 | |
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Name: Inhibitory activity against IMP-1 metallo-beta-lactamase (MBL)
Source: ChEMBL
Target: N/A
External Id: CHEMBL699977
|
|
Name: Inhibition of Pseudomonas aeruginosa IMP1 metallo-beta-lactamase
Source: ChEMBL
Target: Beta-lactamase
External Id: CHEMBL3076630
|
|
Name: Inhibitory activity against CCRA (Bacteroides fragilis) metallo-beta-lactamase
Source: ChEMBL
Target: Beta-lactamase
External Id: CHEMBL875554
|
| D-2-Thioacetyl-3-phenylpropionic Acid |