(2R,3R)-4-(6-aminopurin-9-yl)-2,3-bis(oxidanyl)butanoate

Systemtic Name: (2R,3R)-4-(6-aminopurin-9-yl)-2,3-bis(oxidanyl)butanoate Openeye Name: (2R,3R)-4-(6-aminopurin-9-yl)-2,3-dihydroxy-butanoate CAS Name: (2R,3R)-4-(6-aminopurin-9-yl)-2,3-dihydroxybutanoate IUPAC Name: (2R,3R)-4-(6-aminopurin-9-yl)-2,3-dihydroxybutanoate Traditional Name: (2R,3R)-4-adenin-9-yl-2,3-dihydroxy-butyrate Formula: C9H10N5O4- MolecularWeight: 252.2068

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CC(C(C(=O)[O-])O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C[C@H]([C@H](C(=O)[O-])O)O

InChI

InChI=1S/C9H11N5O4/c10-7-5-8(12-2-11-7)14(3-13-5)1-4(15)6(16)9(17)18/h2-4,6,15-16H,1H2,(H,17,18)(H2,10,11,12)/p-1/t4-,6-/m1/s1