Ethacrynic Acid L-Cysteine Adduct
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Ethacrynic Acid L-Cysteine Adduct
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CAS No:
51246-37-8
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Formula:
C16H19Cl2NO6S
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Chemical Name:
Ethacrynic Acid L-Cysteine Adduct
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Synonyms:
Ethacrynic Acid L-Cysteine Adduct;Cysteine-ethacrynic Acid Adduct;Ethacrynic Acid-cysteine CoMplex;S-[2-[4-(CarboxyMethoxy)-2,3-dichlorobenzoyl]butyl]-L-cysteine, Cysteine-ethacrynic Acid
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CAS No:
Ethacrynic Acid L-Cysteine Adduct Use and Manufacturing
A metabolite of Ethacrynic Acid (E676000) that is a potent inhibitor of sodium-potassium-dichloride cotransport and bumetanide binding. Also an inhibitor of human hepatic glutathione S-transferase isozymes.
Computed Properties
Molecular Weight:424.3
XLogP3:0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:11
Exact Mass:423.0310139
Monoisotopic Mass:423.0310139
Topological Polar Surface Area:152
Heavy Atom Count:26
Complexity:509
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Ethacrynic Acid L-Cysteine Adduct
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