Chem
J-GLOBAL ID：200907020411909094   Nikkaji number：J2.369.456E

2-Amino-3-[[5-(2-amino-2-carboxyethyl)-2,3-dihydroxyphenyl]thio]propionic acid

2-アミノ-3-[[5-(2-アミノ-2-カルボキシエチル)-2,3-ジヒドロキシフェニル]チオ]プロピオン酸
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： C12H16N2O6S
Molecular formula furigana： C12-H16-N2-O6-S
Molecular weight： 316.330
InChI： InChI=1S/C12H16N2O6S/c13-6(11(17)18)1-5-2-8(15)10(16)9(3-5)21-4-7(14)12(19)20/h2-3,6-7,15-16H,1,4,13-14H2,(H,17,18)(H,19,20)
InChI key： SXISMOAILJWTID-UHFFFAOYSA-N
SMILES： NC(CSc1cc(CC(N)C(=O)O)cc(O)c1O)C(=O)O
Systematic name  (3)：
  • 2-アミノ-3-[[5-(2-アミノ-2-カルボキシエチル)-2,3-ジヒドロキシフェニル]チオ]プロピオン酸
  • 2-アミノ-3-{[5-(2-アミノ-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
  • 2-amino-3-{[5-(2-amino-2-carboxyethyl)-2,3-dihydroxyphenyl]sulfanyl}propanoic acid
Other name (1)：
  • 2-Amino-3-[[5-(2-amino-2-carboxyethyl)-2,3-dihydroxyphenyl]thio]propionic acid
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