OntologieschebiclassesCHEBI:59176   
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bromfenac sodium salt sesquihydrate
http://purl.obolibrary.org/obo/CHEBI_59176

The sesquihydrate of the sodium salt of bromfenac. It is used for the management of ocular pain and treatment of postoperative inflammation in patients who have undergone cataract extraction.

Also appears inmicroslm
Exact Synonyms
sodium [2-amino-3-(4-bromobenzoyl)phenyl]acetate--water (2/3)
Related Synonyms
bromfenac monosodium salt sesquihydrate
bromfenac sodium hydrate
bromfenac sodium
sodium 2-amino-3-(4-bromobenzoyl) phenylacetate sesquihydrate
sodium [2-amino-3-(4-bromobenzoyl)phenyl]acetate sesquihydrate
sodium [2-amino-3-(p-bromobenzoyl)phenyl]acetate sesquihydrate
class Information
charge

0

formula

C30H28Br2N2Na2O9

has_dbxref
has_obo_namespace

chebi_ontology

inchi

InChI=1S/2C15H12BrNO3.2Na.3H2O/c2*16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19;;;;;/h2*1-7H,8,17H2,(H,18,19);;;3*1H2/q;;2*+1;;;/p-2

inchikey

PPOSVVJOVKVBPW-UHFFFAOYSA-L

in_subset

3_STAR

mass

766.33900

monoisotopicmass

763.99569

smiles

O.O.O.[Na+].[Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(Br)cc1.Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(Br)cc1

class Relations