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123122-54-3

123122-54-3 Structure

123122-54-3 Structure
IdentificationBack Directory
[Name]

Candoxatrilat
[CAS]

123122-54-3
[Synonyms]

U 73967
UK-73967
Unii-7wu8Bz90th
Candoxatrilat (UK 73967)
Candoxatrilat [usan:inn:ban]
4α-[[[1-[(S)-2-Carboxy-3-(2-methoxyethoxy)propyl]cyclopentyl]carbonyl]amino]cyclohexane-1α-carboxylic acid
(1s,4s)-4-{1-[(2S)-2-carboxy-2-[(2-methoxyethoxy)methyl]ethyl]cyclopentaneamido}cyclohexane-1-carboxylic acid
Cyclohexanecarboxylic acid, 4-(((1-((2S)-2-carboxy-3-(2-methoxyethoxy)propyl)cyclopentyl)carbonyl)amino)-, cis-
[Molecular Formula]

C20H33NO7
[MDL Number]

MFCD00865966
[MOL File]

123122-54-3.mol
[Molecular Weight]

399.481
Chemical PropertiesBack Directory
[Melting point ]

108.5-109.1°
[alpha ]

D +1.4° (c = 1 in methanol)
[Boiling point ]

642.1±55.0 °C(Predicted)
[density ]

1.22±0.1 g/cm3(Predicted)
[pka]

4.32±0.11(Predicted)
Hazard InformationBack Directory
[Uses]

Antihypertensive.
[Definition]

ChEBI: Candoxatrilat is a dicarboxylic acid monoamide obtained by formal condensation between the amino group of cis-4-aminocyclohexanecarboxylic acid and the cyclopentanecarboxylic acid group of 1-[(2S)-2-carboxy-3-(2-methoxyethoxy)propyl]cyclopentanecarboxylic acid. A potent inhibitor of neutral endopeptidase (NEP, neprilysin, EC 3.4.24.11), it is used as its 2,3-dihydro-1H-inden-5-yl ester prodrug in the treatment of chronic heart failure. It has a role as an EC 3.4.24.* (metalloendopeptidase) inhibitor. It is a dicarboxylic acid and a dicarboxylic acid monoamide.
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