Chem
J-GLOBAL ID：200907047345970858   Nikkaji number：J2.075.976C

[[(S)-2-(4-Amino-2-oxo-1,2-dihydropyrimidine-1-yl)-1-(hydroxymethyl)ethoxy]methyl]phosphonic acid 3-(hexadecyloxy)propyl ester

[[(S)-2-(4-アミノ-2-オキソ-1,2-ジヒドロピリミジン-1-イル)-1-(ヒドロキシメチル)エトキシ]メチル]ホスホン酸3-(ヘキサデシルオキシ)プロピル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C27H52N3O7P
Molecular formula furigana： C27-H52-N3-O7-P
Molecular weight： 561.701
InChI： InChI=1S/C27H52N3O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-35-20-16-21-37-38(33,34)24-36-25(23-31)22-30-18-17-26(28)29-27(30)32/h17-18,25,31H,2-16,19-24H2,1H3,(H,33,34)(H2,28,29,32)/t25-/m0/s1
InChI key： WXJFKKQWPMNTIM-VWLOTQADSA-N
SMILES： CCCCCCCCCCCCCCCCOCCCOP(=O)(O)CO[C@H](CO)Cn1ccc(N)nc1=O
Systematic name  (3)：
  • [[(S)-2-(4-アミノ-2-オキソ-1,2-ジヒドロピリミジン-1-イル)-1-(ヒドロキシメチル)エトキシ]メチル]ホスホン酸3-(ヘキサデシルオキシ)プロピル
  • ({[(2S)-1-(4-アミノ-2-オキソ-1,2-ジヒドロピリミジン-1-イル)-3-ヒドロキシプロパン-2-イル]オキシ}メチル)[3-(ヘキサデシルオキシ)プロポキシ]ホスフィン酸
  • ({[(2S)-1-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3-hydroxypropan-2-yl]oxy}methyl)[3-(hexadecyloxy)propoxy]phosphinic acid
Other name (1)：
  • [[(S)-2-(4-Amino-2-oxo-1,2-dihydropyrimidine-1-yl)-1-(hydroxymethyl)ethoxy]methyl]phosphonic acid 3-(hexadecyloxy)propyl ester
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