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CHEBI:31162 - acemetacin

ChEBI IDCHEBI:31162
ChEBI Nameacemetacin
Stars
DefinitionA carboxylic ester that is the carboxymethyl ester of indometacin. A non-steroidal anti-inflammatory drug, it is used in the treatment of rheumatoid arthritis, osteoarthritis, and low back pain, as well as for postoperative pain and inflammation. Its activity is due to both acemetacin and its major metabolite, indometacin.
Last Modified22 February 2017
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FormulaC21H18ClNO6
Net Charge0
Average Mass415.829
Monoisotopic Mass415.08226
SMILESCOc1ccc2c(c1)c(CC(=O)OCC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C21H18ClNO6/c1-12-16(10-20(26)29-11-19(24)25)17-9-15(28-2)7-8-18(17)23(12)21(27)13-3-5-14(22)6-4-13/h3-9H,10-11H2,1-2H3,(H,24,25)
InChIKeyFSQKKOOTNAMONP-UHFFFAOYSA-N

Wikipedia
Roles Classification

ChEBI Ontology
IUPAC Name 
{2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}acetic acid
INNs  Source
acemetacine  frChemIDplus
acemetacinChemIDplus
acemetacinum  laChemIDplus
acemetacina  esChemIDplus
Synonyms  Source
indomethacin glycolic esterChEBI
indometacin glycolic esterChEBI
indomethacin carboxymethyl esterChEBI
indometacin carboxymethyl esterChEBI
K 708ChemIDplus
K-708ChemIDplus
Brand Names  Source
AcemixChEBI
SolartChEBI
EmflexChEBI
RantudilChEBI
Manual XrefsDatabases
AcemetacinWikipedia
D01582KEGG DRUG
DE2234651Patent
US3910952Patent
LSM-5753LINCS
47DrugCentral
Registry NumbersSources
Reaxys:501672Reaxys
CAS:53164-05-9ChemIDplus