CHEBI:116600 - LSM-28055

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ChEBI Name LSM-28055
ChEBI ID CHEBI:116600
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C15H15F3N2O3
Net Charge 0
Average Mass 328.287
Monoisotopic Mass 328.10348
InChI InChI=1S/C15H15F3N2O3/c1-23-10-5-2-4-9(8-10)14(22)20-19-12-7-3-6-11(12)13(21)15(16,17)18/h2,4-5,8,11H,3,6-7H2,1H3,(H,20,22)
InChIKey QQLZMJUYUNOJOL-UHFFFAOYSA-N
SMILES COC1=CC=CC(=C1)C(=O)NN=C2CCCC2C(=O)C(F)(F)F
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing LSM-28055 (CHEBI:116600) is a benzoic acids (CHEBI:22723)
Manual Xref Database
LSM-28055 LINCS
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