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[3-(6-aminopurin-9-yl)oxy-2-oxidanyl-propoxy]methylphosphonic acid

[3-(6-aminopurin-9-yl)oxy-2-oxidanyl-propoxy]methylphosphonic acid

Systemtic Name:[3-(6-aminopurin-9-yl)oxy-2-oxidanyl-propoxy]methylphosphonic acid
Openeye Name:[3-(6-aminopurin-9-yl)oxy-2-hydroxy-propoxy]methylphosphonic acid
CAS Name:[3-(6-aminopurin-9-yl)oxy-2-hydroxypropoxy]methylphosphonic acid
IUPAC Name:[3-(6-aminopurin-9-yl)oxy-2-hydroxypropoxy]methylphosphonic acid
Traditional Name:(3-adenin-9-yloxy-2-hydroxy-propoxy)methylphosphonic acid
Formula: C9H14N5O6P
MolecularWeight: 319.211121
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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2OCC(COCP(=O)(O)O)O


Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2OCC(COCP(=O)(O)O)O


InChI

InChI=1S/C9H14N5O6P/c10-8-7-9(12-3-11-8)14(4-13-7)20-2-6(15)1-19-5-21(16,17)18/h3-4,6,15H,1-2,5H2,(H2,10,11,12)(H2,16,17,18)


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