4-(6-aminopurin-9-yl)butane-1,2-diol

Systemtic Name: 4-(6-aminopurin-9-yl)butane-1,2-diol Openeye Name: 4-(6-aminopurin-9-yl)butane-1,2-diol CAS Name: 4-(6-aminopurin-9-yl)butane-1,2-diol IUPAC Name: 4-(6-aminopurin-9-yl)butane-1,2-diol Traditional Name: 4-adenin-9-ylbutane-1,2-diol Formula: C9H13N5O2 MolecularWeight: 223.23182

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CCC(CO)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CCC(CO)O

InChI

InChI=1S/C9H13N5O2/c10-8-7-9(12-4-11-8)14(5-13-7)2-1-6(16)3-15/h4-6,15-16H,1-3H2,(H2,10,11,12)