5-(6-aminopurin-9-yl)-4-(3-azanylpropoxy)-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: 5-(6-aminopurin-9-yl)-4-(3-azanylpropoxy)-2-(hydroxymethyl)oxolan-3-ol Openeye Name: 4-(3-aminopropoxy)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: 4-(3-aminopropoxy)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3-oxolanol IUPAC Name: 4-(3-aminopropoxy)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol Traditional Name: 5-adenin-9-yl-4-(3-aminopropoxy)-2-methylol-tetrahydrofuran-3-ol Formula: C13H20N6O4 MolecularWeight: 324.3357

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)OCCCN

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)OCCCN

InChI

InChI=1S/C13H20N6O4/c14-2-1-3-22-10-9(21)7(4-20)23-13(10)19-6-18-8-11(15)16-5-17-12(8)19/h5-7,9-10,13,20-21H,1-4,14H2,(H2,15,16,17)