N-[9-[(2R,5S)-5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]purin-6-yl]octanamide

Systemtic Name: N-[9-[(2R,5S)-5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]purin-6-yl]octanamide Openeye Name: N-[9-[(2R,5S)-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]octanamide CAS Name: N-[9-[(2R,5S)-3-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]octanamide IUPAC Name: N-[9-[(2R,5S)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]octanamide Traditional Name: N-[9-[(2R,5S)-3-hydroxy-5-methylol-tetrahydrofuran-2-yl]purin-6-yl]caprylamide Formula: C18H27N5O4 MolecularWeight: 377.43808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=NC=NC2=C1N=CN2C3C(CC(O3)CO)O

Isomeric SMILES

CCCCCCCC(=O)NC1=NC=NC2=C1N=CN2[C@H]3C(C[C@H](O3)CO)O

InChI

InChI=1S/C18H27N5O4/c1-2-3-4-5-6-7-14(26)22-16-15-17(20-10-19-16)23(11-21-15)18-13(25)8-12(9-24)27-18/h10-13,18,24-25H,2-9H2,1H3,(H,19,20,22,26)/t12-,13?,18+/m0/s1