CHEBI:114414 - 4,5-dimethoxy-2-[(1-oxo-2-phenoxypropyl)amino]benzoic acid

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ChEBI Name 4,5-dimethoxy-2-[(1-oxo-2-phenoxypropyl)amino]benzoic acid
ChEBI ID CHEBI:114414
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C18H19NO6
Net Charge 0
Average Mass 345.347
Monoisotopic Mass 345.12124
InChI InChI=1S/C18H19NO6/c1-11(25-12-7-5-4-6-8-12)17(20)19-14-10-16(24-3)15(23-2)9-13(14)18(21)22/h4-11H,1-3H3,(H,19,20)(H,21,22)
InChIKey LKEPKOUIYQXLDG-UHFFFAOYSA-N
SMILES CC(C(=O)NC1=CC(=C(C=C1C(=O)O)OC)OC)OC2=CC=CC=C2
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 4,5-dimethoxy-2-[(1-oxo-2-phenoxypropyl)amino]benzoic acid (CHEBI:114414) is a amidobenzoic acid (CHEBI:48470)
Manual Xref Database
LSM-25875 LINCS
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