Chem
J-GLOBAL ID：200907071627448311   Nikkaji number：J1.218.398D

(2S,3S,4R)-2-(Acetylamino)-3,4,5-triacetoxyvaleric acid methyl ester

(2S,3S,4R)-2-(アセチルアミノ)-3,4,5-トリアセトキシ吉草酸メチル
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： C14H21NO9
Molecular formula furigana： C14-H21-N-O9
Molecular weight： 347.320
InChI： InChI=1S/C14H21NO9/c1-7(16)15-12(14(20)21-5)13(24-10(4)19)11(23-9(3)18)6-22-8(2)17/h11-13H,6H2,1-5H3,(H,15,16)/t11-,12+,13-/m1/s1
InChI key： WCRWEZRWUYNYFD-FRRDWIJNSA-N
SMILES： COC(=O)[C@@H](NC(=O)C)[C@H](OC(=O)C)[C@@H](COC(=O)C)OC(=O)C
Systematic name  (3)：
  • (2S,3S,4R)-2-(アセチルアミノ)-3,4,5-トリアセトキシ吉草酸メチル
  • メチル (2S,3S,4R)-3,4,5-トリス(アセチルオキシ)-2-アセトアミドペンタノアート
  • methyl (2S,3S,4R)-3,4,5-tris(acetyloxy)-2-acetamidopentanoate
Other name (1)：
  • (2S,3S,4R)-2-(Acetylamino)-3,4,5-triacetoxyvaleric acid methyl ester
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