ethoxy-[[(1S,2S,4S)-4-(6-ethoxypurin-9-yl)-2-oxidanyl-cyclopentyl]oxymethyl]phosphinic acid

Systemtic Name: ethoxy-[[(1S,2S,4S)-4-(6-ethoxypurin-9-yl)-2-oxidanyl-cyclopentyl]oxymethyl]phosphinic acid Openeye Name: ethoxy-[[(1S,2S,4S)-4-(6-ethoxypurin-9-yl)-2-hydroxy-cyclopentoxy]methyl]phosphinic acid CAS Name: ethoxy-[[(1S,2S,4S)-4-(6-ethoxy-9-purinyl)-2-hydroxycyclopentyl]oxymethyl]phosphinic acid IUPAC Name: ethoxy-[[(1S,2S,4S)-4-(6-ethoxypurin-9-yl)-2-hydroxycyclopentyl]oxymethyl]phosphinic acid Traditional Name: ethoxy-[[(1S,2S,4S)-4-(6-ethoxypurin-9-yl)-2-hydroxy-cyclopentoxy]methyl]phosphinic acid Formula: C15H23N4O6P MolecularWeight: 386.340081

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC2=C1N=CN2C3CC(C(C3)OCP(=O)(O)OCC)O

Isomeric SMILES

CCOC1=NC=NC2=C1N=CN2[C@H]3C[C@@H]([C@H](C3)OCP(=O)(O)OCC)O

InChI

InChI=1S/C15H23N4O6P/c1-3-23-15-13-14(16-7-17-15)19(8-18-13)10-5-11(20)12(6-10)24-9-26(21,22)25-4-2/h7-8,10-12,20H,3-6,9H2,1-2H3,(H,21,22)/t10-,11-,12-/m0/s1