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

Systemtic Name: [(1S,2S,4S)-4-(6-aminopurin-9-yl)-2-oxidanyl-cyclopentyl]oxymethyl-ethoxy-phosphinic acid Openeye Name: [(1S,2S,4S)-4-(6-aminopurin-9-yl)-2-hydroxy-cyclopentoxy]methyl-ethoxy-phosphinic acid CAS Name: [(1S,2S,4S)-4-(6-aminopurin-9-yl)-2-hydroxycyclopentyl]oxymethyl-ethoxyphosphinic acid IUPAC Name: [(1S,2S,4S)-4-(6-aminopurin-9-yl)-2-hydroxycyclopentyl]oxymethyl-ethoxyphosphinic acid Traditional Name: [(1S,2S,4S)-4-adenin-9-yl-2-hydroxy-cyclopentoxy]methyl-ethoxy-phosphinic acid Formula: C13H20N5O5P MolecularWeight: 357.302161

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COC1CC(CC1O)N2C=NC3=C2N=CN=C3N)O

Isomeric SMILES

CCOP(=O)(CO[C@H]1C[C@H](C[C@@H]1O)N2C=NC3=C2N=CN=C3N)O

InChI

InChI=1S/C13H20N5O5P/c1-2-23-24(20,21)7-22-10-4-8(3-9(10)19)18-6-17-11-12(14)15-5-16-13(11)18/h5-6,8-10,19H,2-4,7H2,1H3,(H,20,21)(H2,14,15,16)/t8-,9-,10-/m0/s1