2-[(6-aminopurin-9-yl)methoxy]ethanol; 2-[(6-aminopurin-9-yl)methoxy]ethylphosphonic acid

Systemtic Name: 2-[(6-aminopurin-9-yl)methoxy]ethanol; 2-[(6-aminopurin-9-yl)methoxy]ethylphosphonic acid Openeye Name: 2-[(6-aminopurin-9-yl)methoxy]ethanol; 2-[(6-aminopurin-9-yl)methoxy]ethylphosphonic acid CAS Name: 2-[(6-aminopurin-9-yl)methoxy]ethanol; 2-[(6-aminopurin-9-yl)methoxy]ethylphosphonic acid IUPAC Name: 2-[(6-aminopurin-9-yl)methoxy]ethanol; 2-[(6-aminopurin-9-yl)methoxy]ethylphosphonic acid Traditional Name: 2-(adenin-9-ylmethoxy)ethanol; 2-(adenin-9-ylmethoxy)ethylphosphonic acid Formula: C16H23N10O6P MolecularWeight: 482.390981

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2COCCO.C1=NC2=C(C(=N1)N)N=CN2COCCP(=O)(O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2COCCO.C1=NC2=C(C(=N1)N)N=CN2COCCP(=O)(O)O

InChI

InChI=1S/C8H12N5O4P.C8H11N5O2/c9-7-6-8(11-3-10-7)13(4-12-6)5-17-1-2-18(14,15)16;9-7-6-8(11-3-10-7)13(4-12-6)5-15-2-1-14/h3-4H,1-2,5H2,(H2,9,10,11)(H2,14,15,16);3-4,14H,1-2,5H2,(H2,9,10,11)