Chem
J-GLOBAL ID：200907024404116165   Nikkaji number：J659.432H

2-(N-Hexadecanoylamino)-4-nitrophenylphosphocholine

2-(N-ヘキサデカノイルアミノ)-4-ニトロフェニルホスホコリン
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： C27H48N[N+]2O4[O-]2P
Molecular formula furigana： C27-H48-N3-O6-P
Molecular weight： 541.670
InChI： InChI=1S/C27H48N3O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27(31)28-25-23-24(29(32)33)19-20-26(25)36-37(34,35)22-21-30(2,3)4/h19-20,23H,5-18,21-22H2,1-4H3,(H-,28,31,34,35)
InChI key： SDXZZCCZIKTXRB-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCCCCC(=O)Nc1cc(ccc1OP(=O)([O-])CC[N+](C)(C)C)[N+](=O)[O-]
Systematic name  (3)：
  • 2-[[2-(ヘキサデカノイルアミノ)-4-ニトロフェノキシ](オキシラト)ホスフィニル]-N,N,N-トリメチルエタンアミニウム
  • 2-ヘキサデカンアミド-4-ニトロフェニル [2-(トリメチルアザニウミル)エチル]ホスホナート
  • 2-hexadecanamido-4-nitrophenyl [2-(trimethylazaniumyl)ethyl]phosphonate
Other name (3)：
  • 2-[[2-(Hexadecanoylamino)-4-nitrophenoxy](oxylato)phosphinyl]-N,N,N-trimethylethanaminium
  • 2-(N-ヘキサデカノイルアミノ)-4-ニトロフェニルホスホコリン
  • 2-(N-Hexadecanoylamino)-4-nitrophenylphosphocholine
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