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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC1C(CC(O1)N2C=NC3=C2NC(=NC3=O)N)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC1C(CC(O1)N2C=NC3=C2NC(=NC3=O)N)O

InChI

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