Chem
J-GLOBAL ID：200907069181075732   Nikkaji number：J1.867.806C

[(αR)-α-[(2-Thienyl)acetylamino]-3-carboxybenzyl]boronic acid

[(αR)-α-[(2-チエニルアセチル)アミノ]-3-カルボキシベンジル]ボロン酸
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： C14H14BNO5S
Molecular formula furigana： C14-H14-B-N-O5-S
Molecular weight： 319.140
InChI： InChI=1S/C14H14BNO5S/c17-12(8-11-5-2-6-22-11)16-13(15(20)21)9-3-1-4-10(7-9)14(18)19/h1-7,13,20-21H,8H2,(H,16,17)(H,18,19)/t13-/m0/s1
InChI key： HQLQTGGLHBYZSA-ZDUSSCGKSA-N
SMILES： OB(O)[C@@H](NC(=O)Cc1cccs1)c1cccc(c1)C(=O)O
Systematic name  (4)：
  • [(αR)-α-[(2-チエニル)アセチルアミノ]-3-カルボキシベンジル]ボロン酸
  • [(αR)-α-[(2-チエニルアセチル)アミノ]-3-カルボキシベンジル]ボロン酸
  • 3-[(R)-(ジヒドロキシボラニル)[2-(チオフェン-2-イル)アセトアミド]メチル]安息香酸
  • 3-[(R)-(dihydroxyboranyl)[2-(thiophen-2-yl)acetamido]methyl]benzoic acid
Other name (2)：
  • [(αR)-α-[(2-Thienyl)acetylamino]-3-carboxybenzyl]boronic acid
  • [(αR)-α-[(2-Thienylacetyl)amino]-3-carboxybenzyl]boronic acid
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