N-[9-[4-hexadecanoyl-4-oxidanyl-5-(1-oxidanyl-2-oxidanylidene-heptadecyl)oxolan-2-yl]-6-oxidanylidene-3H-purin-2-yl]hexadecanamide

Systemtic Name: N-[9-[4-hexadecanoyl-4-oxidanyl-5-(1-oxidanyl-2-oxidanylidene-heptadecyl)oxolan-2-yl]-6-oxidanylidene-3H-purin-2-yl]hexadecanamide Openeye Name: N-[9-[4-hexadecanoyl-4-hydroxy-5-(1-hydroxy-2-oxo-heptadecyl)tetrahydrofuran-2-yl]-6-oxo-3H-purin-2-yl]hexadecanamide CAS Name: N-[9-[4-hydroxy-5-(1-hydroxy-2-oxoheptadecyl)-4-(1-oxohexadecyl)-2-oxolanyl]-6-oxo-3H-purin-2-yl]hexadecanamide IUPAC Name: N-[9-[4-hexadecanoyl-4-hydroxy-5-(1-hydroxy-2-oxoheptadecyl)oxolan-2-yl]-6-oxo-3H-purin-2-yl]hexadecanamide Traditional Name: N-[9-[4-hexadecanoyl-4-hydroxy-5-(1-hydroxy-2-keto-heptadecyl)tetrahydrofuran-2-yl]-6-keto-3H-purin-2-yl]palmitamide Formula: C58H103N5O7 MolecularWeight: 982.46772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C1C(CC(O1)N2C=NC3=C2NC(=NC3=O)NC(=O)CCCCCCCCCCCCCCC)(C(=O)CCCCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C1C(CC(O1)N2C=NC3=C2NC(=NC3=O)NC(=O)CCCCCCCCCCCCCCC)(C(=O)CCCCCCCCCCCCCCC)O)O

InChI

InChI=1S/C58H103N5O7/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-48(64)53(67)54-58(69,49(65)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)46-51(70-54)63-47-59-52-55(63)61-57(62-56(52)68)60-50(66)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h47,51,53-54,67,69H,4-46H2,1-3H3,(H2,60,61,62,66,68)