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CHEBI:117073 - LSM-28520

ChEBI IDCHEBI:117073
ChEBI NameLSM-28520
Stars
DownloadsMolfile
FormulaC16H17NO4
Net Charge0
Average Mass287.315
Monoisotopic Mass287.11576
SMILESCC1(C)CC(=O)C(C=Nc2ccccc2C(=O)O)C(=O)C1
InChIInChI=1S/C16H17NO4/c1-16(2)7-13(18)11(14(19)8-16)9-17-12-6-4-3-5-10(12)15(20)21/h3-6,9,11H,7-8H2,1-2H3,(H,20,21)
InChIKeyQICUJNDCYAGOBK-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)
LSM-28520 (CHEBI:117073) is a benzoic acids (CHEBI:22723)
Manual XrefsDatabases
LSM-28520LINCS