N-[9-[4-oxidanyl-5-(1-oxidanyl-2-oxidanylidene-hexyl)oxolan-2-yl]purin-6-yl]hexadecanamide

Systemtic Name: N-[9-[4-oxidanyl-5-(1-oxidanyl-2-oxidanylidene-hexyl)oxolan-2-yl]purin-6-yl]hexadecanamide Openeye Name: N-[9-[4-hydroxy-5-(1-hydroxy-2-oxo-hexyl)tetrahydrofuran-2-yl]purin-6-yl]hexadecanamide CAS Name: N-[9-[4-hydroxy-5-(1-hydroxy-2-oxohexyl)-2-oxolanyl]-6-purinyl]hexadecanamide IUPAC Name: N-[9-[4-hydroxy-5-(1-hydroxy-2-oxohexyl)oxolan-2-yl]purin-6-yl]hexadecanamide Traditional Name: N-[9-[4-hydroxy-5-(1-hydroxy-2-keto-hexyl)tetrahydrofuran-2-yl]purin-6-yl]palmitamide Formula: C31H51N5O5 MolecularWeight: 573.76714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=NC=NC2=C1N=CN2C3CC(C(O3)C(C(=O)CCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=NC=NC2=C1N=CN2C3CC(C(O3)C(C(=O)CCCC)O)O

InChI

InChI=1S/C31H51N5O5/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-19-25(39)35-30-27-31(33-21-32-30)36(22-34-27)26-20-24(38)29(41-26)28(40)23(37)18-6-4-2/h21-22,24,26,28-29,38,40H,3-20H2,1-2H3,(H,32,33,35,39)