2-(6-aminopurin-9-yl)ethylphosphonic acid; bicyclo[2.1.0]pentan-3-ol

Systemtic Name: 2-(6-aminopurin-9-yl)ethylphosphonic acid; bicyclo[2.1.0]pentan-3-ol Openeye Name: 2-(6-aminopurin-9-yl)ethylphosphonic acid; bicyclo[2.1.0]pentan-3-ol CAS Name: 2-(6-aminopurin-9-yl)ethylphosphonic acid; 3-bicyclo[2.1.0]pentanol IUPAC Name: 2-(6-aminopurin-9-yl)ethylphosphonic acid; bicyclo[2.1.0]pentan-3-ol Traditional Name: 2-adenin-9-ylethylphosphonic acid; bicyclo[2.1.0]pentan-3-ol Formula: C12H18N5O4P MolecularWeight: 327.276181

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C1C(C2)O.C1=NC2=C(C(=N1)N)N=CN2CCP(=O)(O)O

Isomeric SMILES

C1C2C1C(C2)O.C1=NC2=C(C(=N1)N)N=CN2CCP(=O)(O)O

InChI

InChI=1S/C7H10N5O3P.C5H8O/c8-6-5-7(10-3-9-6)12(4-11-5)1-2-16(13,14)15;6-5-2-3-1-4(3)5/h3-4H,1-2H2,(H2,8,9,10)(H2,13,14,15);3-6H,1-2H2