[4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)butyl] (3-octadecoxy-2-oxidanyl-propyl) hydrogen phosphate

Systemtic Name: [4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)butyl] (3-octadecoxy-2-oxidanyl-propyl) hydrogen phosphate Openeye Name: [4-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)butyl] (2-hydroxy-3-octadecoxy-propyl) hydrogen phosphate CAS Name: [4-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)butyl] (2-hydroxy-3-octadecoxypropyl) hydrogen phosphate IUPAC Name: [4-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)butyl] (2-hydroxy-3-octadecoxypropyl) hydrogen phosphate Traditional Name: [4-(2-amino-6-keto-3H-purin-9-yl)-2-methylol-butyl] (2-hydroxy-3-stearyloxy-propyl) hydrogen phosphate Formula: C31H58N5O8P MolecularWeight: 659.794681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC(CCN1C=NC2=C1NC(=NC2=O)N)CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC(CCN1C=NC2=C1NC(=NC2=O)N)CO)O

InChI

InChI=1S/C31H58N5O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-42-23-27(38)24-44-45(40,41)43-22-26(21-37)18-19-36-25-33-28-29(36)34-31(32)35-30(28)39/h25-27,37-38H,2-24H2,1H3,(H,40,41)(H3,32,34,35,39)