[(2R,3S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-hexadecanoyloxy-oxolan-2-yl]methyl hexadecanoate

Systemtic Name: [(2R,3S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-hexadecanoyloxy-oxolan-2-yl]methyl hexadecanoate Openeye Name: [(2R,3S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hexadecanoyloxy-tetrahydrofuran-2-yl]methyl hexadecanoate CAS Name: hexadecanoic acid [(2R,3S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3-(1-oxohexadecoxy)-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-hexadecanoyloxyoxolan-2-yl]methyl hexadecanoate Traditional Name: palmitic acid [(2R,3S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-3-hexadecanoyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C41H73N3O6 MolecularWeight: 704.03482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC1C(CC(O1)N2C=CC(=NC2=O)N)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H](C[C@@H](O1)N2C=CC(=NC2=O)N)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C41H73N3O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-39(45)48-34-36-35(33-38(49-36)44-32-31-37(42)43-41(44)47)50-40(46)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32,35-36,38H,3-30,33-34H2,1-2H3,(H2,42,43,47)/t35-,36+,38+/m0/s1