(1S,2S,3S,5S)-5-(2-azanyl-6-methoxy-purin-9-yl)-3-phenylmethoxy-2-(phenylmethoxymethyl)cyclopentan-1-ol

Systemtic Name: (1S,2S,3S,5S)-5-(2-azanyl-6-methoxy-purin-9-yl)-3-phenylmethoxy-2-(phenylmethoxymethyl)cyclopentan-1-ol Openeye Name: (1S,2S,3S,5S)-5-(2-amino-6-methoxy-purin-9-yl)-3-benzyloxy-2-(benzyloxymethyl)cyclopentanol CAS Name: (1S,2S,3S,5S)-5-(2-amino-6-methoxy-9-purinyl)-3-phenylmethoxy-2-(phenylmethoxymethyl)-1-cyclopentanol IUPAC Name: (1S,2S,3S,5S)-5-(2-amino-6-methoxypurin-9-yl)-3-phenylmethoxy-2-(phenylmethoxymethyl)cyclopentan-1-ol Traditional Name: (1S,2S,3S,5S)-5-(2-amino-6-methoxy-purin-9-yl)-3-benzoxy-2-(benzoxymethyl)cyclopentanol Formula: C26H29N5O4 MolecularWeight: 479.510179

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC2=C1N=CN2C3CC(C(C3O)COCC4=CC=CC=C4)OCC5=CC=CC=C5)N

Isomeric SMILES

CO[13C]1=N[13C](=N[13C]2=[13C]1N=CN2[C@H]3C[C@@H]([C@H]([C@@H]3O)COCC4=CC=CC=C4)OCC5=CC=CC=C5)N

InChI

InChI=1S/C26H29N5O4/c1-33-25-22-24(29-26(27)30-25)31(16-28-22)20-12-21(35-14-18-10-6-3-7-11-18)19(23(20)32)15-34-13-17-8-4-2-5-9-17/h2-11,16,19-21,23,32H,12-15H2,1H3,(H2,27,29,30)/t19-,20+,21+,23+/m1/s1/i22+1,24+1,25+1,26+1