Chemical Component Summary

Name3'-amino-5'-[(2S,4R)-6-carbamimidoyl-4-phenyl-1,2,3,4-tetrahydroquinolin-2-yl]biphenyl-2-carboxylic acid
Identifiers2-[3-azanyl-5-[(2S,4R)-6-carbamimidoyl-4-phenyl-1,2,3,4-tetrahydroquinolin-2-yl]phenyl]benzoic acid
FormulaC29 H26 N4 O2
Molecular Weight462.542
TypeNON-POLYMER
Isomeric SMILES[H]/N=C(\c1ccc2c(c1)[C@H](C[C@H](N2)c3cc(cc(c3)N)c4ccccc4C(=O)O)c5ccccc5)/N
InChIInChI=1S/C29H26N4O2/c30-21-13-19(22-8-4-5-9-23(22)29(34)35)12-20(14-21)27-16-24(17-6-2-1-3-7-17)25-15-18(28(31)32)10-11-26(25)33-27/h1-15,24,27,33H,16,30H2,(H3,31,32)(H,34,35)/t24-,27+/m1/s1
InChIKeyXUJJWQQLMFLJKO-SQHAQQRYSA-N

Chemical Details

Formal Charge0
Atom Count61
Chiral Atom Count2
Bond Count65
Aromatic Bond Count24

Related Resource References

Resource NameReference
Pharos CHEMBL3127485
PubChem 72725807
ChEMBL CHEMBL3127485