Introduction：Basic information about CAS 161973-10-0|Esomeprazole, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Esomeprazole |
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| CAS Number | 161973-10-0 | Molecular Weight | 713.121 |
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| Density | / | Boiling Point | 600ºC at 760 mmHg |
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| Molecular Formula | C34H36MgN6O6S2 | Melting Point | / |
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| MSDS | / | Flash Point | 316.7ºC |
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Names
| Name | esomeprazole magnesium |
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| Synonym | More Synonyms |
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Esomeprazole BiologicalActivity
| Description | Esomeprazole magnesium is an inhibitor of H+, K+-ATPase, effectively used in the research of upper intestinal disorder. |
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| Related Catalog | Signaling Pathways >>Membrane Transporter/Ion Channel >>Proton PumpResearch Areas >>Others |
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| Target | H+, K+-ATPase[1] |
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| In Vitro | Esomeprazole magnesium is an inhibitor of H+, K+-ATPase[1]. |
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| In Vivo | Esomeprazole magnesium (0.5, 5, 50 mg/kg/day, p.o.) produces increased gastric total antioxidant capacity, decreases gastric lipid peroxide levels, significantly increases superoxide dismutase levels, but shows no obvious effect on colonic lipid peroxide levels in mice[1]. |
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| Animal Admin | Mice[1] In this 10-day supplementation experiment, mice (n = 10/group) receive the following: 1) as a control group, only the vehicle for dissolution of Esomeprazole (PEG-400) given orally once daily by gastric gavage; 2) Esomeprazole 0.5 mg/kg in an equivalent volume of PEG-400 given orally once daily by gastric lavage; 3) Esomeprazole 5 mg/kg in an equivalent volume of PEG-400 given orally once daily by gastric lavage; and 4) Esomeprazole 50 mg/kg in an equivalent volume of PEG-400 given orally once daily by gastric lavage[1]. |
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| References | [1]. Koch TR, et al. Effect of the H, K-ATPase inhibitor, esomeprazole magnesium, on gut total antioxidant capacity in mice. J Nutr Biochem. 2004 Sep;15(9):522-6. |
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Chemical & Physical Properties
| Boiling Point | 600ºC at 760 mmHg |
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| Molecular Formula | C34H36MgN6O6S2 |
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| Molecular Weight | 713.121 |
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| Flash Point | 316.7ºC |
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| Exact Mass | 712.198792 |
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| PSA | 186.82000 |
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| LogP | 6.78900 |
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| Vapour Pressure | 2.35E-14mmHg at 25°C |
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| InChIKey | KWORUUGOSLYAGD-FHPCUDFMSA-N |
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| SMILES | COc1ccc2[n-]c(S(=O)Cc3ncc(C)c(OC)c3C)nc2c1.COc1ccc2[n-]c(S(=O)Cc3ncc(C)c(OC)c3C)nc2c1.[Mg+2] |
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| Storage condition | -20℃ |
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Synonyms
| (-)-Omeprazole magnesium |
| Nexium |
| H-199/18 |
| omeprazole magnesium |
| EsMeprazole Magne-siuM Trihydrate |
| sulfonium, hydroxy(6-methoxy-1H-benzimidazol-2-yl)[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-, inner salt, magnesium salt (2:1) |
| H 199/18 |
| (T-4-(S),(S))-Bis(5-methoxy-2-(((4-methoxy-3,5-dimethyl-2-pyridinyl)methyl)sulfinyl)-1H-benzimidazolato)magnesium |
| (S)-Omeprazole magnesium |
| (T-4)-Bis(5-methoxy-2-((S)-((4-methoxy-3,5-dimethyl-2-pyridinyl)methyl)sulfinyl-kO)-1H-benzimidazolato-kN1)magnesium |
| Magnesium bis(5-methoxy-2-{(S)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl}benzimidazol-1-ide) |
| Esomeprazole magnesium |
| 1H-Benzimidazole, 5-methoxy-2-[(S)-[(1S)-(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-, magnesium salt (2:1) |
| Magnesium bis{(6-methoxybenzimidazol-1-id-2-yl)[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfoniumolate} |
| Magnesium bis(5-methoxy-2-{(S)-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfinyl}benzimidazol-1-ide) |
| Esomeprazole |
