9-[(2R,3S)-4-azanylidene-2,3,5-tris(oxidanyl)pentanimidoyl]-3H-purin-6-one

Systemtic Name: 9-[(2R,3S)-4-azanylidene-2,3,5-tris(oxidanyl)pentanimidoyl]-3H-purin-6-one Openeye Name: 9-[(2R,3S)-2,3,5-trihydroxy-4-imino-pentanimidoyl]-3H-purin-6-one CAS Name: 9-[(2R,3S)-2,3,5-trihydroxy-1,4-diiminopentyl]-3H-purin-6-one IUPAC Name: 9-[(2R,3S)-2,3,5-trihydroxy-4-iminopentanimidoyl]-3H-purin-6-one Traditional Name: 9-[(2R,3S)-2,3,5-trihydroxy-4-imino-pentanimidoyl]-3H-purin-6-one Formula: C10H12N6O4 MolecularWeight: 280.24008

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N(C=N2)C(=N)C(C(C(=N)CO)O)O

Isomeric SMILES

C1=NC(=O)C2=C(N1)N(C=N2)C(=N)[C@H]([C@H](C(=N)CO)O)O

InChI

InChI=1S/C10H12N6O4/c11-4(1-17)6(18)7(19)8(12)16-3-15-5-9(16)13-2-14-10(5)20/h2-3,6-7,11-12,17-19H,1H2,(H,13,14,20)/t6-,7-/m0/s1