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CHEBI:40046 - 4'-(4-{4-[(2-CARBOXYPHENYL)AMINO]PHENOXY}BUTOXY)-1,1'-BIPHENYL-4-CARBOXYLIC ACID

Default Structure
ChEBI IDCHEBI:40046
ChEBI Name4'-(4-{4-[(2-CARBOXYPHENYL)AMINO]PHENOXY}BUTOXY)-1,1'-BIPHENYL-4-CARBOXYLIC ACID
Stars
DownloadsMolfile
FormulaC30H27NO6
Net Charge0
Average Mass497.547
Monoisotopic Mass497.18384
SMILES[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(OC([H])([H])C([H])([H])C([H])([H])C([H])([H])Oc3c([H])c([H])c(N([H])c4c([H])c([H])c([H])c([H])c4C(=O)O[H])c([H])c3[H])c([H])c2[H])c([H])c1[H]
InChIInChI=1S/C30H27NO6/c32-29(33)23-9-7-21(8-10-23)22-11-15-25(16-12-22)36-19-3-4-20-37-26-17-13-24(14-18-26)31-28-6-2-1-5-27(28)30(34)35/h1-2,5-18,31H,3-4,19-20H2,(H,32,33)(H,34,35)
InChIKeyPBSDQYSNDJNJGR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4'-(4-{4-[(2-CARBOXYPHENYL)AMINO]PHENOXY}BUTOXY)-1,1'-BIPHENYL-4-CARBOXYLIC ACID (CHEBI:40046) is a unclassifieds (CHEBI:27189)
Synonym  Source
4'-(4-{4-[(2-CARBOXYPHENYL)AMINO]PHENOXY}BUTOXY)-1,1'-BIPHENYL-4-CARBOXYLIC ACIDPDBeChem
Manual XrefsDatabases
44CPDBeChem