2-[[2-aminocarbonyl-4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]phenyl]carbonylamino]-5-oxidanylidene-5-[(4-oxidanyl-4-oxidanylidene-butyl)amino]pentanoic acid

Systemtic Name: 2-[[2-aminocarbonyl-4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]phenyl]carbonylamino]-5-oxidanylidene-5-[(4-oxidanyl-4-oxidanylidene-butyl)amino]pentanoic acid Openeye Name: 2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]-2-carbamoyl-benzoyl]amino]-5-[(4-hydroxy-4-oxo-butyl)amino]-5-oxo-pentanoic acid CAS Name: 2-[[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]-2-carbamoylphenyl]-oxomethyl]amino]-5-[(4-hydroxy-4-oxobutyl)amino]-5-oxopentanoic acid IUPAC Name: 2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]-2-carbamoylbenzoyl]amino]-5-[(4-hydroxy-4-oxobutyl)amino]-5-oxopentanoic acid Traditional Name: 2-[[4-[(2-amino-4-keto-1H-pteridin-6-yl)methylamino]-2-carbamoyl-benzoyl]amino]-5-[(4-hydroxy-4-keto-butyl)amino]-5-keto-valeric acid Formula: C24H27N9O8 MolecularWeight: 569.52668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCC2=CN=C3C(=N2)C(=O)N=C(N3)N)C(=O)N)C(=O)NC(CCC(=O)NCCCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1NCC2=CN=C3C(=N2)C(=O)N=C(N3)N)C(=O)N)C(=O)NC(CCC(=O)NCCCC(=O)O)C(=O)O

InChI

InChI=1S/C24H27N9O8/c25-19(37)14-8-11(28-9-12-10-29-20-18(30-12)22(39)33-24(26)32-20)3-4-13(14)21(38)31-15(23(40)41)5-6-16(34)27-7-1-2-17(35)36/h3-4,8,10,15,28H,1-2,5-7,9H2,(H2,25,37)(H,27,34)(H,31,38)(H,35,36)(H,40,41)(H3,26,29,32,33,39)