2-[5-[[2,4-bis(azanyl)pteridin-6-yl]methyl-methyl-amino]pentanoylamino]pentanedioic acid

Systemtic Name: 2-[5-[[2,4-bis(azanyl)pteridin-6-yl]methyl-methyl-amino]pentanoylamino]pentanedioic acid Openeye Name: 2-[5-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]pentanoylamino]pentanedioic acid CAS Name: 2-[[5-[(2,4-diamino-6-pteridinyl)methyl-methylamino]-1-oxopentyl]amino]pentanedioic acid IUPAC Name: 2-[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]pentanoylamino]pentanedioic acid Traditional Name: 2-[5-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]pentanoylamino]glutaric acid Formula: C18H26N8O5 MolecularWeight: 434.44964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCC(=O)NC(CCC(=O)O)C(=O)O)CC1=CN=C2C(=N1)C(=NC(=N2)N)N

Isomeric SMILES

CN(CCCCC(=O)NC(CCC(=O)O)C(=O)O)CC1=CN=C2C(=N1)C(=NC(=N2)N)N

InChI

InChI=1S/C18H26N8O5/c1-26(9-10-8-21-16-14(22-10)15(19)24-18(20)25-16)7-3-2-4-12(27)23-11(17(30)31)5-6-13(28)29/h8,11H,2-7,9H2,1H3,(H,23,27)(H,28,29)(H,30,31)(H4,19,20,21,24,25)