[5-[4-(octadecanoylamino)-2-oxidanylidene-pyrimidin-1-yl]oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [5-[4-(octadecanoylamino)-2-oxidanylidene-pyrimidin-1-yl]oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [5-[4-(octadecanoylamino)-2-oxo-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [5-[2-oxo-4-(1-oxooctadecylamino)-1-pyrimidinyl]-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [5-[4-(octadecanoylamino)-2-oxopyrimidin-1-yl]oxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [5-(2-keto-4-stearamido-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C27H48N3O7P MolecularWeight: 557.659681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC1=NC(=O)N(C=C1)C2CCC(O2)COP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC1=NC(=O)N(C=C1)C2CCC(O2)COP(=O)(O)O

InChI

InChI=1S/C27H48N3O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(31)28-24-20-21-30(27(32)29-24)26-19-18-23(37-26)22-36-38(33,34)35/h20-21,23,26H,2-19,22H2,1H3,(H2,33,34,35)(H,28,29,31,32)