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

Systemtic Name: [(2R)-1-(6-aminopurin-9-yl)-3-oxidanyl-propan-2-yl]oxymethyl-(2-octadecoxyethoxy)phosphinic acid Openeye Name: [(1R)-1-[(6-aminopurin-9-yl)methyl]-2-hydroxy-ethoxy]methyl-(2-octadecoxyethoxy)phosphinic acid CAS Name: [(2R)-1-(6-aminopurin-9-yl)-3-hydroxypropan-2-yl]oxymethyl-(2-octadecoxyethoxy)phosphinic acid IUPAC Name: [(2R)-1-(6-aminopurin-9-yl)-3-hydroxypropan-2-yl]oxymethyl-(2-octadecoxyethoxy)phosphinic acid Traditional Name: [(1R)-1-(adenin-9-ylmethyl)-2-hydroxy-ethoxy]methyl-(2-stearyloxyethoxy)phosphinic acid Formula: C29H54N5O6P MolecularWeight: 599.742721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCOP(=O)(COC(CN1C=NC2=C1N=CN=C2N)CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCOP(=O)(CO[C@H](CN1C=NC2=C1N=CN=C2N)CO)O

InChI

InChI=1S/C29H54N5O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-38-19-20-40-41(36,37)25-39-26(22-35)21-34-24-33-27-28(30)31-23-32-29(27)34/h23-24,26,35H,2-22,25H2,1H3,(H,36,37)(H2,30,31,32)/t26-/m1/s1