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CHEBI:32057 - proglumetacin dimaleate

ChEBI IDCHEBI:32057
ChEBI Nameproglumetacin dimaleate
Stars
DefinitionA maleate salt obtained by combining proglumetacin with two molar equivalents of maleic acid. Used to control pain and inflammation associated with musculoskeletal and joint disorders. Following oral adminitration, it is metabolied to indometacin and proglumide, a drug with antisecretory effects that helps prevent injury to the stomach lining.
Last Modified14 November 2013
DownloadsMolfile
FormulaC46H58ClN5O8.2C4H4O4
Net Charge0
Average Mass1076.594
Monoisotopic Mass1075.41931
SMILESCCCN(CCC)C(=O)C(CCC(=O)OCCCN1CCN(CCOC(=O)Cc2c(C)n(C(=O)c3ccc(Cl)cc3)c3ccc(OC)cc23)CC1)NC(=O)c1ccccc1.O=C(O)/C=C\C(=O)O.O=C(O)/C=C\C(=O)O
InChIInChI=1S/C46H58ClN5O8.2C4H4O4/c1-5-21-51(22-6-2)46(57)40(48-44(55)34-11-8-7-9-12-34)18-20-42(53)59-29-10-23-49-24-26-50(27-25-49)28-30-60-43(54)32-38-33(3)52(41-19-17-37(58-4)31-39(38)41)45(56)35-13-15-36(47)16-14-35;2*5-3(6)1-2-4(7)8/h7-9,11-17,19,31,40H,5-6,10,18,20-30,32H2,1-4H3,(H,48,55);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKeyMKFWBVKQDGNXDW-SPIKMXEPSA-N
Roles Classification
Biological Roles:
lipoxygenase inhibitor  A compound or agent that combines with lipoxygenase and thereby prevents its substrate-enzyme combination with arachidonic acid and the formation of the icosanoid products hydroxyicosatetraenoic acid and various leukotrienes.
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor  A compound or agent that combines with cyclooxygenases (EC 1.14.99.1) and thereby prevents its substrate-enzyme combination with arachidonic acid and the formation of icosanoids, prostaglandins, and thromboxanes.
non-narcotic analgesic  A drug that has principally analgesic, antipyretic and anti-inflammatory actions. Non-narcotic analgesics do not bind to opioid receptors.
Applications:
antipyretic  A drug that prevents or reduces fever by lowering the body temperature from a raised state. An antipyretic will not affect the normal body temperature if one does not have fever. Antipyretics cause the hypothalamus to override an interleukin-induced increase in temperature. The body will then work to lower the temperature and the result is a reduction in fever.
non-steroidal anti-inflammatory drug  An anti-inflammatory drug that is not a steroid. In addition to anti-inflammatory actions, non-steroidal anti-inflammatory drugs have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins.
non-narcotic analgesic  A drug that has principally analgesic, antipyretic and anti-inflammatory actions. Non-narcotic analgesics do not bind to opioid receptors.
ChEBI Ontology
Outgoing Relation(s)
proglumetacin dimaleate (CHEBI:32057) has part proglumetacin (CHEBI:76263)
proglumetacin dimaleate (CHEBI:32057) has role antipyretic (CHEBI:35493)
proglumetacin dimaleate (CHEBI:32057) has role EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor (CHEBI:35544)
proglumetacin dimaleate (CHEBI:32057) has role lipoxygenase inhibitor (CHEBI:35856)
proglumetacin dimaleate (CHEBI:32057) has role non-narcotic analgesic (CHEBI:35481)
proglumetacin dimaleate (CHEBI:32057) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
proglumetacin dimaleate (CHEBI:32057) is a maleate salt (CHEBI:50221)
IUPAC Name 
3-[4-(2-{2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}ethyl)piperazin-1-yl]propyl N2-benzoyl-N,N-dipropyl-α-glutaminate di[(2Z)-but-2-enedioate]
Synonym  Source
Proglumetacin maleateChemIDplus
Brand Name  Source
MiridacinKEGG DRUG
Manual XrefsDatabases
D01765KEGG DRUG
Registry NumbersSources
Reaxys:15391370Reaxys
CAS:59209-40-4KEGG DRUG
CAS:59209-40-4ChemIDplus
Citations