ODE-CDV (Q15425303)

[(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(2-octadecoxyethoxy)phosphinic acid (English)

21 September 2016

chemical formula

C₂₈H₅₄N₃O₇P

1 reference

[(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(2-octadecoxyethoxy)phosphinic acid (English)

21 September 2016

canonical SMILES

CCCCCCCCCCCCCCCCCCOCCOP(=O)(COC(CN1C=CC(=NC1=O)N)CO)O

1 reference

[(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(2-octadecoxyethoxy)phosphinic acid (English)

21 September 2016

isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCOP(=O)(CO[C@@H](CN1C=CC(=NC1=O)N)CO)O

1 reference

[(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(2-octadecoxyethoxy)phosphinic acid (English)

InChI=1S/C28H54N3O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-36-21-22-38-39(34,35)25-37-26(24-32)23-31-19-18-27(29)30-28(31)33/h18-19,26,32H,2-17,20-25H2,1H3,(H,34,35)(H2,29,30,33)/t26-/m0/s1

21 September 2016

Identifiers

InChI

1 reference

[(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(2-octadecoxyethoxy)phosphinic acid (English)

BLYNHZVAZVOTGV-SANMLTNESA-N

21 September 2016

InChIKey

1 reference

[(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(2-octadecoxyethoxy)phosphinic acid (English)

21 September 2016

1 reference

Octadecyloxyethyl-cidofovir (English)

21 September 2016

2 references

[(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(2-octadecoxyethoxy)phosphinic acid (English)

matched by identifier from

21 September 2016

InChIKey

BLYNHZVAZVOTGV-SANMLTNESA-N

1 reference