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CHEBI:750374 - s-777469

Default Structure
ChEBI IDCHEBI:750374
ChEBI Names-777469
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC23H27FN2O4
Net Charge0
Average Mass414.477
Monoisotopic Mass414.19549
SMILESCCc1c(C)cc(C(=O)NC2(C(=O)O)CCCCC2)c(=O)n1Cc1ccc(F)cc1
InChIInChI=1S/C23H27FN2O4/c1-3-19-15(2)13-18(20(27)25-23(22(29)30)11-5-4-6-12-23)21(28)26(19)14-16-7-9-17(24)10-8-16/h7-10,13H,3-6,11-12,14H2,1-2H3,(H,25,27)(H,29,30)
InChIKeyJIYXOJFSPOFZPY-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Application:
dermatologic drug  A drug used to treat or prevent skin disorders or for the routine care of skin.
ChEBI Ontology
Outgoing Relation(s)
s-777469 (CHEBI:750374) has role dermatologic drug (CHEBI:50177)
s-777469 (CHEBI:750374) is a N-acyl-amino acid (CHEBI:51569)
Synonym  Source
S-777469ChEMBL
Citations