[4-[7-(2-azanyl-3-phenyl-propanoyl)oxy-5-oxidanyl-4-oxidanylidene-chromen-3-yl]phenyl] 2-azanyl-3-phenyl-propanoate

Systemtic Name: [4-[7-(2-azanyl-3-phenyl-propanoyl)oxy-5-oxidanyl-4-oxidanylidene-chromen-3-yl]phenyl] 2-azanyl-3-phenyl-propanoate Openeye Name: [4-[7-(2-amino-3-phenyl-propanoyl)oxy-5-hydroxy-4-oxo-chromen-3-yl]phenyl] 2-amino-3-phenyl-propanoate CAS Name: 2-amino-3-phenylpropanoic acid [4-[7-(2-amino-1-oxo-3-phenylpropoxy)-5-hydroxy-4-oxo-1-benzopyran-3-yl]phenyl] ester IUPAC Name: [4-[7-(2-amino-3-phenylpropanoyl)oxy-5-hydroxy-4-oxochromen-3-yl]phenyl] 2-amino-3-phenylpropanoate Traditional Name: 2-amino-3-phenyl-propionic acid [4-(5-hydroxy-4-keto-7-phenylalanyloxy-chromen-3-yl)phenyl] ester Formula: C33H28N2O7 MolecularWeight: 564.58462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OC2=CC=C(C=C2)C3=COC4=CC(=CC(=C4C3=O)O)OC(=O)C(CC5=CC=CC=C5)N)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OC2=CC=C(C=C2)C3=COC4=CC(=CC(=C4C3=O)O)OC(=O)C(CC5=CC=CC=C5)N)N

InChI

InChI=1S/C33H28N2O7/c34-26(15-20-7-3-1-4-8-20)32(38)41-23-13-11-22(12-14-23)25-19-40-29-18-24(17-28(36)30(29)31(25)37)42-33(39)27(35)16-21-9-5-2-6-10-21/h1-14,17-19,26-27,36H,15-16,34-35H2