Chem
J-GLOBAL ID：200907021408074760   Nikkaji number：J1.035.724A

N-(β-Alanyl)-3-hydroxy-5-[[(S)-2-amino-2-carboxyethyl]thio]-D-tyrosine

N-(β-アラニル)-3-ヒドロキシ-5-[[(S)-2-アミノ-2-カルボキシエチル]チオ]-D-チロシン
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： C15H21N3O7S
Molecular formula furigana： C15-H21-N3-O7-S
Molecular weight： 387.410
InChI： InChI=1S/C15H21N3O7S/c16-2-1-12(20)18-9(15(24)25)3-7-4-10(19)13(21)11(5-7)26-6-8(17)14(22)23/h4-5,8-9,19,21H,1-3,6,16-17H2,(H,18,20)(H,22,23)(H,24,25)/t8-,9-/m1/s1
InChI key： SQMIUYQEBZQYLZ-RKDXNWHRSA-N
SMILES： NCCC(=O)N[C@H](Cc1cc(O)c(O)c(SC[C@@H](N)C(=O)O)c1)C(=O)O
Systematic name  (3)：
  • N-(β-アラニル)-3-ヒドロキシ-5-[[(S)-2-アミノ-2-カルボキシエチル]チオ]-D-チロシン
  • (2S)-2-アミノ-3-({5-[(2R)-2-(3-アミノプロパンアミド)-2-カルボキシエチル]-2,3-ジヒドロキシフェニル}スルファニル)プロパン酸
  • (2S)-2-amino-3-({5-[(2R)-2-(3-aminopropanamido)-2-carboxyethyl]-2,3-dihydroxyphenyl}sulfanyl)propanoic acid
Other name (1)：
  • N-(β-Alanyl)-3-hydroxy-5-[[(S)-2-amino-2-carboxyethyl]thio]-D-tyrosine
Thsaurus map：
Thesaurus Map

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