[(E)-5-(6-aminopurin-9-yl)pent-1-enyl]phosphonic acid

Systemtic Name: [(E)-5-(6-aminopurin-9-yl)pent-1-enyl]phosphonic acid Openeye Name: [(E)-5-(6-aminopurin-9-yl)pent-1-enyl]phosphonic acid CAS Name: [(E)-5-(6-aminopurin-9-yl)pent-1-enyl]phosphonic acid IUPAC Name: [(E)-5-(6-aminopurin-9-yl)pent-1-enyl]phosphonic acid Traditional Name: [(E)-5-adenin-9-ylpent-1-enyl]phosphonic acid Formula: C10H14N5O3P MolecularWeight: 283.223621

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CCCC=CP(=O)(O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CCC/C=C/P(=O)(O)O

InChI

InChI=1S/C10H14N5O3P/c11-9-8-10(13-6-12-9)15(7-14-8)4-2-1-3-5-19(16,17)18/h3,5-7H,1-2,4H2,(H2,11,12,13)(H2,16,17,18)/b5-3+