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CHEBI:140536 - bromfenac sodium salt

Default Structure
ChEBI IDCHEBI:140536
ChEBI Namebromfenac sodium salt
Stars
DefinitionThe sodium salt of bromfenac. Note that 'bromfenac sodium' commonly refers to the sesquihydrate (120638-55-3); this is the anhydrous form.
Last Modified21 January 2016
DownloadsMolfile
FormulaC15H11BrNO3.Na
Net Charge0
Average Mass356.151
Monoisotopic Mass354.98200
SMILESNc1c(CC(=O)[O-])cccc1C(=O)c1ccc(Br)cc1.[Na+]
InChIInChI=1S/C15H12BrNO3.Na/c16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19;/h1-7H,8,17H2,(H,18,19);/q;+1/p-1
InChIKeyHZFGMQJYAFHESD-UHFFFAOYSA-M
Roles Classification
Biological Role:
non-narcotic analgesic  A drug that has principally analgesic, antipyretic and anti-inflammatory actions. Non-narcotic analgesics do not bind to opioid receptors.
Applications:
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)
bromfenac sodium salt (CHEBI:140536) has part bromfenac(1−) (CHEBI:59175)
bromfenac sodium salt (CHEBI:140536) has role non-narcotic analgesic (CHEBI:35481)
bromfenac sodium salt (CHEBI:140536) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
bromfenac sodium salt (CHEBI:140536) is a organic sodium salt (CHEBI:38700)
Incoming Relation(s)
bromfenac sodium salt sesquihydrate (CHEBI:59176) has part bromfenac sodium salt (CHEBI:140536)
IUPAC Name 
sodium [2-amino-3-(4-bromobenzoyl)phenyl]acetate
Synonyms  Source
bromfenac sodiumChemIDplus
Sodium; [2-amino-3-(4-bromo-benzoyl)-phenyl]-acetateChEMBL
Registry NumbersSources
Beilstein:6034130Beilstein
CAS:91714-93-1ChemIDplus