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CHEBI:748762 - gw590735

Default Structure
ChEBI IDCHEBI:748762
ChEBI Namegw590735
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC23H21F3N2O4S
Net Charge0
Average Mass478.492
Monoisotopic Mass478.11741
SMILESCc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)NCc1ccc(OC(C)(C)C(=O)O)cc1
InChIInChI=1S/C23H21F3N2O4S/c1-13-18(33-20(28-13)15-6-8-16(9-7-15)23(24,25)26)19(29)27-12-14-4-10-17(11-5-14)32-22(2,3)21(30)31/h4-11H,12H2,1-3H3,(H,27,29)(H,30,31)
InChIKeyILUPZUOBHCUBKB-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
gw590735 (CHEBI:748762) is a monocarboxylic acid (CHEBI:25384)
Synonyms  Source
Gw590735ChEMBL
GW-590735ChEMBL
Citations