[2-ethoxy-3-(octadecanoylamino)propyl] [5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl hydrogen phosphate

Systemtic Name: [2-ethoxy-3-(octadecanoylamino)propyl] [5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl hydrogen phosphate Openeye Name: [2-ethoxy-3-(octadecanoylamino)propyl] [5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl hydrogen phosphate CAS Name: [2-ethoxy-3-(1-oxooctadecylamino)propyl] [5-(6-oxo-3H-purin-9-yl)-2-oxolanyl]methyl hydrogen phosphate IUPAC Name: [2-ethoxy-3-(octadecanoylamino)propyl] [5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl hydrogen phosphate Traditional Name: (2-ethoxy-3-stearamido-propyl) [5-(6-keto-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl hydrogen phosphate Formula: C33H58N5O8P MolecularWeight: 683.816081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)(O)OCC1CCC(O1)N2C=NC3=C2NC=NC3=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)(O)OCC1CCC(O1)N2C=NC3=C2NC=NC3=O)OCC

InChI

InChI=1S/C33H58N5O8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-29(39)34-22-28(43-4-2)24-45-47(41,42)44-23-27-20-21-30(46-27)38-26-37-31-32(38)35-25-36-33(31)40/h25-28,30H,3-24H2,1-2H3,(H,34,39)(H,41,42)(H,35,36,40)