Chem
J-GLOBAL ID:200907062095566320   Nikkaji number:J1.954.953D

O-(2-Oxo-6-bromo-7-hydroxy-2H-1-benzopyran-4-ylmethoxycarbonyl)-L-tyrosine methyl ester

O-(2-オキソ-6-ブロモ-7-ヒドロキシ-2H-1-ベンゾピラン-4-イルメトキシカルボニル)-L-チロシンメチル
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: C21H18BrNO8
Molecular formula furigana: C21-H18-BR-N-O8
Molecular weight: 492.278
InChI: InChI=1S/C21H18BrNO8/c1-28-20(26)16(23)6-11-2-4-13(5-3-11)30-21(27)29-10-12-7-19(25)31-18-9-17(24)15(22)8-14(12)18/h2-5,7-9,16,24H,6,10,23H2,1H3/t16-/m0/s1
InChI key: LGMNGHKOICKGIG-INIZCTEOSA-N
SMILES: COC(=O)[C@@H](N)Cc1ccc(OC(=O)OCc2cc(=O)oc3cc(O)c(Br)cc23)cc1
Systematic name  (5):
  • O-(2-オキソ-6-ブロモ-7-ヒドロキシ-2H-1-ベンゾピラン-4-イルメトキシカルボニル)-L-チロシンメチル
  • O-[[(2-オキソ-6-ブロモ-7-ヒドロキシ-2H-1-ベンゾピラン-4-イル)メトキシ]カルボニル]-L-チロシンメチル
  • O-[(6-ブロモ-7-ヒドロキシ-2-オキソ-2H-1-ベンゾピラン-4-イル)メトキシカルボニル]-L-チロシンメチル
  • メチル (2S)-2-アミノ-3-[4-({[(6-ブロモ-7-ヒドロキシ-2-オキソ-2H-クロメン-4-イル)メトキシ]カルボニル}オキシ)フェニル]プロパノアート
  • methyl (2S)-2-amino-3-[4-({[(6-bromo-7-hydroxy-2-oxo-2H-chromen-4-yl)methoxy]carbonyl}oxy)phenyl]propanoate
Other name (3):
  • O-(2-Oxo-6-bromo-7-hydroxy-2H-1-benzopyran-4-ylmethoxycarbonyl)-L-tyrosine methyl ester
  • O-[[(2-Oxo-6-bromo-7-hydroxy-2H-1-benzopyran-4-yl)methoxy]carbonyl]-L-tyrosine methyl ester
  • O-[(6-Bromo-7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)methoxycarbonyl]-L-tyrosine methyl ester
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