2-[[[4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]phenyl]-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[[4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]phenyl]-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phenyl]-hydroxy-phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phenyl]-hydroxyphosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phenyl]-hydroxyphosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[[4-[(2-amino-4-keto-1H-pteridin-6-yl)methylamino]phenyl]-hydroxy-phosphoryl]methyl]glutaric acid Formula: C19H21N6O7P MolecularWeight: 476.379801

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N6O7P/c20-19-24-16-15(17(28)25-19)23-12(8-22-16)7-21-11-2-4-13(5-3-11)33(31,32)9-10(18(29)30)1-6-14(26)27/h2-5,8,10,21H,1,6-7,9H2,(H,26,27)(H,29,30)(H,31,32)(H3,20,22,24,25,28)