Chem
J-GLOBAL ID:200907099278060167   Nikkaji number:J2.098.052D

(-)-SMA-7

(-)-SMA-7
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: C26H44F2NO5P
Molecular formula furigana: C26-H44-F2-N-O5-P
Molecular weight: 519.611
InChI: InChI=1S/C26H44F2NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-24(30)29-23(21-26(27,28)35(32,33)34)25(31)22-18-15-14-16-19-22/h14-16,18-19,23,25,31H,2-13,17,20-21H2,1H3,(H,29,30)(H2,32,33,34)/t23-,25+/m1/s1
InChI key: KQPGDBVGEXAZAW-NOZRDPDXSA-N
SMILES: CCCCCCCCCCCCCCCC(=O)N[C@H](CC(F)(F)P(=O)(O)O)[C@@H](O)c1ccccc1
Systematic name  (5):
  • [(3R,4S)-1,1-ジフルオロ-4-ヒドロキシ-3-(ヘキサデカノイルアミノ)-4-フェニルブチル]ホスホン酸
  • N-[(1R,2S)-2-フェニル-2-ヒドロキシ-1-[2-ホスホノ-2,2-ジフルオロエチル]エチル]ヘキサデカンアミド
  • N-[[(1S,2R)-4,4-ジフルオロ-1-ヒドロキシ-1-フェニル-4-ホスホノブタン]-2-イル]ヘキサデカンアミド
  • [(3R,4S)-1,1-ジフルオロ-3-ヘキサデカンアミド-4-ヒドロキシ-4-フェニルブチル]ホスホン酸
  • [(3R,4S)-1,1-difluoro-3-hexadecanamido-4-hydroxy-4-phenylbutyl]phosphonic acid
Other name (5):
  • [(3R,4S)-1,1-Difluoro-4-hydroxy-3-(hexadecanoylamino)-4-phenylbutyl]phosphonic acid
  • N-[(1R,2S)-2-Phenyl-2-hydroxy-1-[2-phosphono-2,2-difluoroethyl]ethyl]hexadecanamide
  • (-)-SMA-7
  • N-[[(1S,2R)-4,4-Difluoro-1-hydroxy-1-phenyl-4-phosphonobutane]-2-yl]hexadecanamide
  • SMA-7
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