Chem
J-GLOBAL ID:200907031974302937   Nikkaji number:J23.327G

N-(2,4-Dihydroxy-3,3-dimethylbutyryl)-β-alanine

3-(2,4-ジヒドロキシ-3,3-ジメチルブタンアミド)プロパン酸
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: C9H17NO5
Molecular formula furigana: C9-H17-N-O5
Molecular weight: 219.237
InChI: InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)
InChI key: GHOKWGTUZJEAQD-UHFFFAOYSA-N
SMILES: CC(C)(CO)C(O)C(=O)NCCC(=O)O
Systematic name  (4):
  • N-(2,4-ジヒドロキシ-3,3-ジメチル-1-オキソブチル)-β-アラニン
  • N-(2,4-ジヒドロキシ-3,3-ジメチルブチリル)-β-アラニン
  • 3-(2,4-ジヒドロキシ-3,3-ジメチルブタンアミド)プロパン酸
  • 3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoic acid
Other name (1):
  • N-(2,4-Dihydroxy-3,3-dimethylbutyryl)-β-alanine
Regulation number (1):
  • 2-(4)-189
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