Chem
J-GLOBAL ID:200907078339675588   Nikkaji number:J128.679J

N-[2-(2-Heptenoylamino)ethyl]-N-(2-hydroxyethyl)-N,N-bis(2-carboxybutyl)ammonium betaine

N-[2-(2-ヘプテノイルアミノ)エチル]-N-(2-ヒドロキシエチル)-N,N-ビス(2-カルボキシブチル)アンモニウムベタイン
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: C21H38N[N+]O5[O-]
Molecular formula furigana: C21-H38-N2-O6
Molecular weight: 414.543
InChI: InChI=1S/C21H38N2O6/c1-4-7-8-9-10-19(25)22-11-12-23(13-14-24,15-17(5-2)20(26)27)16-18(6-3)21(28)29/h9-10,17-18,24H,4-8,11-16H2,1-3H3,(H2-,22,25,26,27,28,29)
InChI key: QCWOQIWBEKVOSP-UHFFFAOYSA-N
SMILES: CCCCC=CC(=O)NCC[N+](CCO)(CC(CC)C(=O)O)CC(CC)C(=O)[O-]
Systematic name  (3):
  • 2-カルボキシ-N-(2-カルボキシラトブチル)-N-[2-(2-ヘプテノイルアミノ)エチル]-N-(2-ヒドロキシエチル)-1-ブタンアミニウム
  • 2-{[(2-カルボキシ-2-エチルエチル)[2-(ヘプタ-2-エンアミド)エチル](2-ヒドロキシエチル)アザニウミル]メチル}ブタノアート
  • 2-{[(2-carboxy-2-ethylethyl)[2-(hept-2-enamido)ethyl](2-hydroxyethyl)azaniumyl]methyl}butanoate
Other name (3):
  • N-[2-(2-Heptenoylamino)ethyl]-N-(2-hydroxyethyl)-N,N-bis(2-carboxybutyl)ammonium betaine
  • N-[2-(2-ヘプテノイルアミノ)エチル]-N-(2-ヒドロキシエチル)-N,N-ビス(2-カルボキシブチル)アンモニウムベタイン
  • 2-Carboxy-N-(2-carboxylatobutyl)-N-[2-(2-heptenoylamino)ethyl]-N-(2-hydroxyethyl)-1-butanaminium
Regulation number (1):
  • (2)-1258
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