2-[[4-[(2-azanyl-4-phenylmethoxy-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[(2-azanyl-4-phenylmethoxy-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[(2-amino-4-benzyloxy-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid CAS Name: 2-[[[4-[(2-amino-4-phenylmethoxy-6-pteridinyl)methylamino]phenyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[(2-amino-4-phenylmethoxypteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[(2-amino-4-benzoxy-pteridin-6-yl)methylamino]benzoyl]amino]glutaric acid Formula: C26H25N7O6 MolecularWeight: 531.52

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NC(=NC3=NC=C(N=C32)CNC4=CC=C(C=C4)C(=O)NC(CCC(=O)O)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC(=NC3=NC=C(N=C32)CNC4=CC=C(C=C4)C(=O)NC(CCC(=O)O)C(=O)O)N

InChI

InChI=1S/C26H25N7O6/c27-26-32-22-21(24(33-26)39-14-15-4-2-1-3-5-15)30-18(13-29-22)12-28-17-8-6-16(7-9-17)23(36)31-19(25(37)38)10-11-20(34)35/h1-9,13,19,28H,10-12,14H2,(H,31,36)(H,34,35)(H,37,38)(H2,27,29,32,33)