2-(6-aminopurin-9-yl)ethoxymethyl-[2,3-bis(oxidanyl)propoxy]phosphinic acid

Systemtic Name: 2-(6-aminopurin-9-yl)ethoxymethyl-[2,3-bis(oxidanyl)propoxy]phosphinic acid Openeye Name: 2-(6-aminopurin-9-yl)ethoxymethyl-(2,3-dihydroxypropoxy)phosphinic acid CAS Name: 2-(6-aminopurin-9-yl)ethoxymethyl-(2,3-dihydroxypropoxy)phosphinic acid IUPAC Name: 2-(6-aminopurin-9-yl)ethoxymethyl-(2,3-dihydroxypropoxy)phosphinic acid Traditional Name: 2-adenin-9-ylethoxymethyl(glyceryloxy)phosphinic acid Formula: C11H18N5O6P MolecularWeight: 347.264281

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(O)OCC(CO)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(O)OCC(CO)O

InChI

InChI=1S/C11H18N5O6P/c12-10-9-11(14-5-13-10)16(6-15-9)1-2-21-7-23(19,20)22-4-8(18)3-17/h5-6,8,17-18H,1-4,7H2,(H,19,20)(H2,12,13,14)