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CHEBI:82603 - zofenoprilat arginine

ChEBI IDCHEBI:82603
ChEBI Namezofenoprilat arginine
Stars
DefinitionAn organoammonium salt obtained by combining zofenoprilat with one molar equivalent of L-arginine.
Last Modified31 July 2014
SubmitterSteve
DownloadsMolfile
FormulaC15H19NO3S2.C6H14N4O2
Net Charge0
Average Mass499.659
Monoisotopic Mass499.19231
SMILESC[C@H](CS)C(=O)N1C[C@@H](Sc2ccccc2)C[C@H]1C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O
InChIInChI=1S/C15H19NO3S2.C6H14N4O2/c1-10(9-20)14(17)16-8-12(7-13(16)15(18)19)21-11-5-3-2-4-6-11;7-4(5(11)12)2-1-3-10-6(8)9/h2-6,10,12-13,20H,7-9H2,1H3,(H,18,19);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t10-,12+,13+;4-/m10/s1
InChIKeyOSKWTWSFSUAPKP-KQUFBQNASA-N
Wikipedia
Roles Classification
Biological Roles:
apoptosis inhibitor  Any substance that inhibits the process of apoptosis (programmed cell death) in multi-celled organisms.
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor  An EC 3.4.15.* (peptidyl-dipeptidase) inhibitor that interferes with the action of peptidyl-dipeptidase A (EC 3.4.15.1).
Applications:
cardioprotective agent  Any protective agent that is able to prevent damage to the heart.
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor  An EC 3.4.15.* (peptidyl-dipeptidase) inhibitor that interferes with the action of peptidyl-dipeptidase A (EC 3.4.15.1).
vasodilator agent  A drug used to cause dilation of the blood vessels.
anticonvulsant  A drug used to prevent seizures or reduce their severity.
ChEBI Ontology
Outgoing Relation(s)
zofenoprilat arginine (CHEBI:82603) has part L-argininium(1+) (CHEBI:32682)
zofenoprilat arginine (CHEBI:82603) has part zofenoprilat(1−) (CHEBI:82604)
zofenoprilat arginine (CHEBI:82603) has role anticonvulsant (CHEBI:35623)
zofenoprilat arginine (CHEBI:82603) has role apoptosis inhibitor (CHEBI:68494)
zofenoprilat arginine (CHEBI:82603) has role cardioprotective agent (CHEBI:77307)
zofenoprilat arginine (CHEBI:82603) has role EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor (CHEBI:35457)
zofenoprilat arginine (CHEBI:82603) has role vasodilator agent (CHEBI:35620)
zofenoprilat arginine (CHEBI:82603) is a organoammonium salt (CHEBI:46850)
IUPAC Names 
(4S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]-4-(phenylsulfanyl)-L-proline—L-arginine (1/1)
(2S)-2-azaniumyl-5-{[ammonio(imino)methyl]amino}pentanoate (2S,4S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]-4-(phenylsulfanyl)pyrrolidine-2-carboxylate
Synonym  Source
SQ 26703ChemIDplus
Manual XrefsDatabases
D03776KEGG DRUG
ZofenoprilatWikipedia
Registry NumbersSources
Reaxys:6468634Reaxys
CAS:81872-09-5ChemIDplus