XGX

(1P)-2'-[(4-carbamimidoylphenyl)carbamoyl]-4'-ethenyl-4-[(2-methylpropyl)carbamoyl][1,1'-biphenyl]-2-carboxylic acid


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Chemical Component Summary

Name(1P)-2'-[(4-carbamimidoylphenyl)carbamoyl]-4'-ethenyl-4-[(2-methylpropyl)carbamoyl][1,1'-biphenyl]-2-carboxylic acid
SynonymsBCX2627
Identifiers2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-ethenyl-phenyl]-5-(2-methylpropylcarbamoyl)benzoic acid
FormulaC28 H28 N4 O4
Molecular Weight484.546
TypeNON-POLYMER
Isomeric SMILES[H]/N=C(\c1ccc(cc1)NC(=O)c2cc(ccc2c3ccc(cc3C(=O)O)C(=O)NCC(C)C)C=C)/N
InChIInChI=1S/C28H28N4O4/c1-4-17-5-11-21(23(13-17)27(34)32-20-9-6-18(7-10-20)25(29)30)22-12-8-19(14-24(22)28(35)36)26(33)31-15-16(2)3/h4-14,16H,1,15H2,2-3H3,(H3,29,30)(H,31,33)(H,32,34)(H,35,36)
InChIKeyFCTCJAGJUHHZDO-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count64
Chiral Atom Count0
Bond Count66
Aromatic Bond Count18