Chem
J-GLOBAL ID：200907014252983598   Nikkaji number：J1.852.412K

TAK-559

TAK-559
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： C28H26N2O5
Molecular formula furigana： C28-H26-N2-O5
Molecular weight： 470.525
InChI： InChI=1S/C28H26N2O5/c1-20-26(29-28(35-20)23-10-6-3-7-11-23)19-33-24-14-12-21(13-15-24)18-34-30-25(16-17-27(31)32)22-8-4-2-5-9-22/h2-15H,16-19H2,1H3,(H,31,32)/b30-25+
InChI key： ULVDFHLHKNJICZ-QCWLDUFUSA-N
SMILES： Cc1oc(nc1COc1ccc(CO/N=C(\CCC(=O)O)/c2ccccc2)cc1)c1ccccc1
Systematic name  (3)：
  • γ-[(E)-4-(2-フェニル-5-メチル-4-オキサゾリルメトキシ)ベンジルオキシイミノ]ベンゼン酪酸
  • (4E)-4-[({4-[(5-メチル-2-フェニル-1,3-オキサゾール-4-イル)メトキシ]フェニル}メトキシ)イミノ]-4-フェニルブタン酸
  • (4E)-4-[({4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl}methoxy)imino]-4-phenylbutanoic acid
Other name (2)：
  • γ-[(E)-4-(2-Phenyl-5-methyl-4-oxazolylmethoxy)benzyloxyimino]benzenebutyric acid
  • TAK-559
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