CHEBI:109500 - 2-[oxo-[2-[oxo-(2-phenylethylamino)methyl]anilino]methyl]-1-cyclohexanecarboxylic acid

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ChEBI Name 2-[oxo-[2-[oxo-(2-phenylethylamino)methyl]anilino]methyl]-1-cyclohexanecarboxylic acid
ChEBI ID CHEBI:109500
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H26N2O4
Net Charge 0
Average Mass 394.464
Monoisotopic Mass 394.18926
InChI InChI=1S/C23H26N2O4/c26-21(24-15-14-16-8-2-1-3-9-16)19-12-6-7-13-20(19)25-22(27)17-10-4-5-11-18(17)23(28)29/h1-3,6-9,12-13,17-18H,4-5,10-11,14-15H2,(H,24,26)(H,25,27)(H,28,29)
InChIKey AALCHAKPJXCSQC-UHFFFAOYSA-N
SMILES C1CCC(C(C1)C(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)C(=O)O
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 2-[oxo-[2-[oxo-(2-phenylethylamino)methyl]anilino]methyl]-1-cyclohexanecarboxylic acid (CHEBI:109500) is a amidobenzoic acid (CHEBI:48470)
Manual Xref Database
LSM-20898 LINCS
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