Chem
J-GLOBAL ID:200907098512260616   Nikkaji number:J1.948.815B

(3S)-β-Phenethyl-L-aspartic acid

(3S)-β-フェネチル-L-アスパラギン酸
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: C12H15NO4
Molecular formula furigana: C12-H15-N-O4
Molecular weight: 237.255
InChI: InChI=1S/C12H15NO4/c13-10(12(16)17)9(11(14)15)7-6-8-4-2-1-3-5-8/h1-5,9-10H,6-7,13H2,(H,14,15)(H,16,17)/t9-,10-/m0/s1
InChI key: VTOGLVSBYYMMEY-UWVGGRQHSA-N
SMILES: N[C@@H]([C@H](CCc1ccccc1)C(=O)O)C(=O)O
Systematic name  (4):
  • (3S)-β-フェネチル-L-アスパラギン酸
  • (3S)-3-フェネチル-L-アスパラギン酸
  • (2S,3S)-2-アミノ-3-(2-フェニルエチル)ブタン二酸
  • (2S,3S)-2-amino-3-(2-phenylethyl)butanedioic acid
Other name (2):
  • (3S)-β-Phenethyl-L-aspartic acid
  • (3S)-3-Phenethyl-L-aspartic acid
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