[1-[5-(6-aminopurin-9-yl)-3-ethanoyl-3-oxidanyl-oxolan-2-yl]-2-oxidanylidene-propyl] hexadecanoate

Systemtic Name: [1-[5-(6-aminopurin-9-yl)-3-ethanoyl-3-oxidanyl-oxolan-2-yl]-2-oxidanylidene-propyl] hexadecanoate Openeye Name: [1-[3-acetyl-5-(6-aminopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]-2-oxo-propyl] hexadecanoate CAS Name: hexadecanoic acid [1-[3-acetyl-5-(6-aminopurin-9-yl)-3-hydroxy-2-oxolanyl]-2-oxopropyl] ester IUPAC Name: [1-[3-acetyl-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]-2-oxopropyl] hexadecanoate Traditional Name: palmitic acid [1-(3-acetyl-5-adenin-9-yl-3-hydroxy-tetrahydrofuran-2-yl)-2-keto-propyl] ester Formula: C30H47N5O6 MolecularWeight: 573.72408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(C1C(CC(O1)N2C=NC3=C2N=CN=C3N)(C(=O)C)O)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(C1C(CC(O1)N2C=NC3=C2N=CN=C3N)(C(=O)C)O)C(=O)C

InChI

InChI=1S/C30H47N5O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(38)41-26(21(2)36)27-30(39,22(3)37)18-23(40-27)35-20-34-25-28(31)32-19-33-29(25)35/h19-20,23,26-27,39H,4-18H2,1-3H3,(H2,31,32,33)