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2-[1-[2-[7-(carboxymethyl)-3-methyl-2,6-bis(oxidanylidene)purin-1-yl]ethyl]-3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoic acid

2-[1-[2-[7-(carboxymethyl)-3-methyl-2,6-bis(oxidanylidene)purin-1-yl]ethyl]-3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoic acid

Systemtic Name:2-[1-[2-[7-(carboxymethyl)-3-methyl-2,6-bis(oxidanylidene)purin-1-yl]ethyl]-3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoic acid
Openeye Name:2-[1-[2-[7-(carboxymethyl)-3-methyl-2,6-dioxo-purin-1-yl]ethyl]-3-methyl-2,6-dioxo-purin-7-yl]acetic acid
CAS Name:2-[1-[2-[7-(carboxymethyl)-3-methyl-2,6-dioxo-1-purinyl]ethyl]-3-methyl-2,6-dioxo-7-purinyl]acetic acid
IUPAC Name:2-[1-[2-[7-(carboxymethyl)-3-methyl-2,6-dioxopurin-1-yl]ethyl]-3-methyl-2,6-dioxopurin-7-yl]acetic acid
Traditional Name:2-[1-[2-[7-(carboxymethyl)-2,6-diketo-3-methyl-purin-1-yl]ethyl]-2,6-diketo-3-methyl-purin-7-yl]acetic acid
Formula: C18H18N8O8
MolecularWeight: 474.38432
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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CCN3C(=O)C4=C(N=CN4CC(=O)O)N(C3=O)C)N(C=N2)CC(=O)O


Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CCN3C(=O)C4=C(N=CN4CC(=O)O)N(C3=O)C)N(C=N2)CC(=O)O


InChI

InChI=1S/C18H18N8O8/c1-21-13-11(23(7-19-13)5-9(27)28)15(31)25(17(21)33)3-4-26-16(32)12-14(22(2)18(26)34)20-8-24(12)6-10(29)30/h7-8H,3-6H2,1-2H3,(H,27,28)(H,29,30)


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