[4-oxidanyl-5-(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)oxolan-2-yl]methyl hexadecanoate

Systemtic Name: [4-oxidanyl-5-(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)oxolan-2-yl]methyl hexadecanoate Openeye Name: [4-hydroxy-5-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl hexadecanoate CAS Name: hexadecanoic acid [4-hydroxy-5-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-2-oxolanyl]methyl ester IUPAC Name: [4-hydroxy-5-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)oxolan-2-yl]methyl hexadecanoate Traditional Name: palmitic acid [4-hydroxy-5-(4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C26H42N4O5 MolecularWeight: 490.63548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC1CC(C(O1)N2C3=NC=NC(=O)C3=CN2)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC1CC(C(O1)N2C3=NC=NC(=O)C3=CN2)O

InChI

InChI=1S/C26H42N4O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23(32)34-18-20-16-22(31)26(35-20)30-24-21(17-29-30)25(33)28-19-27-24/h17,19-20,22,26,29,31H,2-16,18H2,1H3