Chem
J-GLOBAL ID:200907044759026826   Nikkaji number:J1.061.252G

[1,1-Difluoro-1-(6-carboxyamidoglutamicnaphth-2-yl)methyl]phosphonic acid

[1,1-ジフルオロ-1-(6-カルボキシアミドグルタミックナフト-2-イル)メチル]ホスホン酸
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: C17H17F2N2O7P
Molecular formula furigana: C17-H17-F2-N2-O7-P
Molecular weight: 430.301
InChI: InChI=1S/C17H17F2N2O7P/c18-17(19,29(26,27)28)12-4-3-9-7-11(2-1-10(9)8-12)16(25)21-13(15(20)24)5-6-14(22)23/h1-4,7-8,13H,5-6H2,(H2,20,24)(H,21,25)(H,22,23)(H2,26,27,28)/t13-/m0/s1
InChI key: OWWCIKSGGKYNHT-ZDUSSCGKSA-N
SMILES: NC(=O)[C@H](CCC(=O)O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(=O)(O)O
Systematic name  (3):
  • (S)-4-[[6-[ジフルオロ(ホスホノ)メチル]ナフタレン-2-イル]カルボニルアミノ]-5-アミノ-5-オキソペンタン酸
  • (4S)-4-カルバモイル-4-({6-[ジフルオロ(ホスホノ)メチル]ナフタレン-2-イル}ホルムアミド)ブタン酸
  • (4S)-4-carbamoyl-4-({6-[difluoro(phosphono)methyl]naphthalen-2-yl}formamido)butanoic acid
Other name (3):
  • (S)-4-[[6-[Difluoro(phosphono)methyl]naphthalene-2-yl]carbonylamino]-5-amino-5-oxopentanoic acid
  • [1,1-ジフルオロ-1-(6-カルボキシアミドグルタミックナフト-2-イル)メチル]ホスホン酸
  • [1,1-Difluoro-1-(6-carboxyamidoglutamicnaphth-2-yl)methyl]phosphonic acid
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