[(1S,2R)-2-(6-aminopurin-9-yl)-2-phenyl-cyclopropyl]methoxymethylphosphonic acid

Systemtic Name: [(1S,2R)-2-(6-aminopurin-9-yl)-2-phenyl-cyclopropyl]methoxymethylphosphonic acid Openeye Name: [(1S,2R)-2-(6-aminopurin-9-yl)-2-phenyl-cyclopropyl]methoxymethylphosphonic acid CAS Name: [(1S,2R)-2-(6-aminopurin-9-yl)-2-phenylcyclopropyl]methoxymethylphosphonic acid IUPAC Name: [(1S,2R)-2-(6-aminopurin-9-yl)-2-phenylcyclopropyl]methoxymethylphosphonic acid Traditional Name: [(1S,2R)-2-adenin-9-yl-2-phenyl-cyclopropyl]methoxymethylphosphonic acid Formula: C16H18N5O4P MolecularWeight: 375.318981

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1(C2=CC=CC=C2)N3C=NC4=C3N=CN=C4N)COCP(=O)(O)O

Isomeric SMILES

C1[C@@H]([C@]1(C2=CC=CC=C2)N3C=NC4=C3N=CN=C4N)COCP(=O)(O)O

InChI

InChI=1S/C16H18N5O4P/c17-14-13-15(19-8-18-14)21(9-20-13)16(11-4-2-1-3-5-11)6-12(16)7-25-10-26(22,23)24/h1-5,8-9,12H,6-7,10H2,(H2,17,18,19)(H2,22,23,24)/t12-,16+/m1/s1