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

Systemtic Name: [1-[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-ethanoyl-3-oxidanyl-oxolan-2-yl]-2-oxidanylidene-propyl] hexadecanoate Openeye Name: [1-[3-acetyl-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]-2-oxo-propyl] hexadecanoate CAS Name: hexadecanoic acid [1-[3-acetyl-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]-2-oxopropyl] ester IUPAC Name: [1-[3-acetyl-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]-2-oxopropyl] hexadecanoate Traditional Name: palmitic acid [1-[3-acetyl-5-(2-amino-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]-2-keto-propyl] ester Formula: C30H47N5O7 MolecularWeight: 589.72348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(C1C(CC(O1)N2C=NC3=C2NC(=NC3=O)N)(C(=O)C)O)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(C1C(CC(O1)N2C=NC3=C2NC(=NC3=O)N)(C(=O)C)O)C(=O)C

InChI

InChI=1S/C30H47N5O7/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(38)42-25(20(2)36)26-30(40,21(3)37)18-22(41-26)35-19-32-24-27(35)33-29(31)34-28(24)39/h19,22,25-26,40H,4-18H2,1-3H3,(H3,31,33,34,39)