Chem
J-GLOBAL ID:200907018083509801   Nikkaji number:J1.015.960A

N-(1-Oxo-3-methyl-8-hydroxy-3,4-dihydro-1H-2-benzopyran-7-ylcarbonyl)-L-phenylalanine methyl ester

N-(1-オキソ-3-メチル-8-ヒドロキシ-3,4-ジヒドロ-1H-2-ベンゾピラン-7-イルカルボニル)-L-フェニルアラニンメチル
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: C21H21NO6
Molecular formula furigana: C21-H21-N-O6
Molecular weight: 383.400
InChI: InChI=1S/C21H21NO6/c1-12-10-14-8-9-15(18(23)17(14)21(26)28-12)19(24)22-16(20(25)27-2)11-13-6-4-3-5-7-13/h3-9,12,16,23H,10-11H2,1-2H3,(H,22,24)/t12?,16-/m0/s1
InChI key: AHCWMOFIRSZKKF-INSVYWFGSA-N
SMILES: COC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc2CC(C)OC(=O)c2c1O
Systematic name  (3):
  • N-(1-オキソ-3-メチル-8-ヒドロキシ-3,4-ジヒドロ-1H-2-ベンゾピラン-7-イルカルボニル)-L-フェニルアラニンメチル
  • メチル (2S)-2-[(8-ヒドロキシ-3-メチル-1-オキソ-3,4-ジヒドロ-1H-2-ベンゾピラン-7-イル)ホルムアミド]-3-フェニルプロパノアート
  • methyl (2S)-2-[(8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl)formamido]-3-phenylpropanoate
Other name (1):
  • N-(1-Oxo-3-methyl-8-hydroxy-3,4-dihydro-1H-2-benzopyran-7-ylcarbonyl)-L-phenylalanine methyl ester
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