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2-[(6-oxidanylidene-3,7-dihydropurin-2-yl)amino]butanedioic acid

2-[(6-oxidanylidene-3,7-dihydropurin-2-yl)amino]butanedioic acid

Systemtic Name:2-[(6-oxidanylidene-3,7-dihydropurin-2-yl)amino]butanedioic acid
Openeye Name:2-[(6-oxo-3,7-dihydropurin-2-yl)amino]butanedioic acid
CAS Name:2-[(6-oxo-3,7-dihydropurin-2-yl)amino]butanedioic acid
IUPAC Name:2-[(6-oxo-3,7-dihydropurin-2-yl)amino]butanedioic acid
Traditional Name:2-[(6-keto-3,7-dihydropurin-2-yl)amino]succinic acid
Formula: C9H9N5O5
MolecularWeight: 267.19826
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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=O)N=C(N2)NC(CC(=O)O)C(=O)O


Isomeric SMILES

C1=NC2=C(N1)C(=O)N=C(N2)NC(CC(=O)O)C(=O)O


InChI

InChI=1S/C9H9N5O5/c15-4(16)1-3(8(18)19)12-9-13-6-5(7(17)14-9)10-2-11-6/h2-3H,1H2,(H,15,16)(H,18,19)(H3,10,11,12,13,14,17)


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