Chem
J-GLOBAL ID：200907091008289153   Nikkaji number：J2.007.596A

(3S)-3-(Benzyloxy)-L-aspartic acid 1-[2-oxo-7-(2-oxo-2-hydroxyethoxy)-2H-1-benzopyran-4-ylmethyl] ester

(3S)-3-(ベンジルオキシ)-L-アスパラギン酸1-[2-オキソ-7-(2-オキソ-2-ヒドロキシエトキシ)-2H-1-ベンゾピラン-4-イルメチル]
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： C23H21NO10
Molecular formula furigana： C23-H21-N-O10
Molecular weight： 471.418
InChI： InChI=1S/C23H21NO10/c24-20(21(22(28)29)32-10-13-4-2-1-3-5-13)23(30)33-11-14-8-19(27)34-17-9-15(6-7-16(14)17)31-12-18(25)26/h1-9,20-21H,10-12,24H2,(H,25,26)(H,28,29)/t20-,21-/m0/s1
InChI key： YLMXXTPWVQKARU-SFTDATJTSA-N
SMILES： N[C@@H]([C@H](OCc1ccccc1)C(=O)O)C(=O)OCc1cc(=O)oc2cc(OCC(=O)O)ccc12
Systematic name  (3)：
  • (3S)-3-(ベンジルオキシ)-L-アスパラギン酸1-[2-オキソ-7-(2-オキソ-2-ヒドロキシエトキシ)-2H-1-ベンゾピラン-4-イルメチル]
  • (2S,3S)-3-アミノ-2-(ベンジルオキシ)-4-{[7-(カルボキシメトキシ)-2-オキソ-2H-クロメン-4-イル]メトキシ}-4-オキソブタン酸
  • (2S,3S)-3-amino-2-(benzyloxy)-4-{[7-(carboxymethoxy)-2-oxo-2H-chromen-4-yl]methoxy}-4-oxobutanoic acid
Other name (1)：
  • (3S)-3-(Benzyloxy)-L-aspartic acid 1-[2-oxo-7-(2-oxo-2-hydroxyethoxy)-2H-1-benzopyran-4-ylmethyl] ester
Thsaurus map：
Thesaurus Map

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