[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hexadecanoate

Systemtic Name: [5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hexadecanoate Openeye Name: [5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl] hexadecanoate CAS Name: hexadecanoic acid [5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)-3-oxolanyl] ester IUPAC Name: [5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hexadecanoate Traditional Name: palmitic acid [5-(2-amino-6-keto-3H-purin-9-yl)-2-methylol-tetrahydrofuran-3-yl] ester Formula: C26H43N5O5 MolecularWeight: 505.65012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC1CC(OC1CO)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC1CC(OC1CO)N2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C26H43N5O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22(33)36-19-16-21(35-20(19)17-32)31-18-28-23-24(31)29-26(27)30-25(23)34/h18-21,32H,2-17H2,1H3,(H3,27,29,30,34)