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3-[2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)ethyl]pentanedioic acid

3-[2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)ethyl]pentanedioic acid

Systemtic Name:3-[2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)ethyl]pentanedioic acid
Openeye Name:3-[2-(2-amino-6-oxo-3H-purin-9-yl)ethyl]pentanedioic acid
CAS Name:3-[2-(2-amino-6-oxo-3H-purin-9-yl)ethyl]pentanedioic acid
IUPAC Name:3-[2-(2-amino-6-oxo-3H-purin-9-yl)ethyl]pentanedioic acid
Traditional Name:3-[2-(2-amino-6-keto-3H-purin-9-yl)ethyl]glutaric acid
Formula: C12H15N5O5
MolecularWeight: 309.278
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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCC(CC(=O)O)CC(=O)O)NC(=NC2=O)N


Isomeric SMILES

C1=NC2=C(N1CCC(CC(=O)O)CC(=O)O)NC(=NC2=O)N


InChI

InChI=1S/C12H15N5O5/c13-12-15-10-9(11(22)16-12)14-5-17(10)2-1-6(3-7(18)19)4-8(20)21/h5-6H,1-4H2,(H,18,19)(H,20,21)(H3,13,15,16,22)


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