[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(3-hexadecanoyloxy-2-oxidanyl-propoxy)phosphinic acid

Systemtic Name: [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(3-hexadecanoyloxy-2-oxidanyl-propoxy)phosphinic acid Openeye Name: [(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-(3-hexadecanoyloxy-2-hydroxy-propoxy)phosphinic acid CAS Name: [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[2-hydroxy-3-(1-oxohexadecoxy)propoxy]phosphinic acid IUPAC Name: [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(3-hexadecanoyloxy-2-hydroxypropoxy)phosphinic acid Traditional Name: [(1R)-2-adenin-9-yl-1-methyl-ethoxy]methyl-(3-hexadecanoyloxy-2-hydroxy-propoxy)phosphinic acid Formula: C28H50N5O7P MolecularWeight: 599.699661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(COC(C)CN1C=NC2=C1N=CN=C2N)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(CO[C@H](C)CN1C=NC2=C1N=CN=C2N)O)O

InChI

InChI=1S/C28H50N5O7P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25(35)38-18-24(34)19-40-41(36,37)22-39-23(2)17-33-21-32-26-27(29)30-20-31-28(26)33/h20-21,23-24,34H,3-19,22H2,1-2H3,(H,36,37)(H2,29,30,31)/t23-,24?/m1/s1