[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]-3-oxidanyl-propyl] (2-decoxy-3-dodecylsulfanyl-propyl) hydrogen phosphate

Systemtic Name: [2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]-3-oxidanyl-propyl] (2-decoxy-3-dodecylsulfanyl-propyl) hydrogen phosphate Openeye Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxy-propyl] (2-decoxy-3-dodecylsulfanyl-propyl) hydrogen phosphate CAS Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxypropyl] [2-decoxy-3-(dodecylthio)propyl] hydrogen phosphate IUPAC Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxypropyl] (2-decoxy-3-dodecylsulfanylpropyl) hydrogen phosphate Traditional Name: [2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]-3-hydroxy-propyl] [2-decoxy-3-(laurylthio)propyl] hydrogen phosphate Formula: C34H64N5O8PS MolecularWeight: 733.939421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC(COP(=O)(O)OCC(CO)OCN1C=NC2=C1NC(=NC2=O)N)OCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCSCC(COP(=O)(O)OCC(CO)OCN1C=NC2=C1NC(=NC2=O)N)OCCCCCCCCCC

InChI

InChI=1S/C34H64N5O8PS/c1-3-5-7-9-11-13-14-16-18-20-22-49-26-30(44-21-19-17-15-12-10-8-6-4-2)25-47-48(42,43)46-24-29(23-40)45-28-39-27-36-31-32(39)37-34(35)38-33(31)41/h27,29-30,40H,3-26,28H2,1-2H3,(H,42,43)(H3,35,37,38,41)