Chem
J-GLOBAL ID:200907016703053339   Nikkaji number:J140.018E

Bis[N-(3-hydroxypropyl)-N-(3-octenoylaminomethyl)glycine]calcium salt

ビス[N-(3-ヒドロキシプロピル)-N-(3-オクテノイルアミノメチル)グリシン]カルシウム
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: C28H50CaN4O8
Molecular formula furigana: C28-H50-CA-N4-O8
Molecular weight: 610.806
InChI: InChI=1S/2C14H26N2O4.Ca/c2*1-2-3-4-5-6-8-13(18)15-12-16(9-7-10-17)11-14(19)20;/h2*5-6,17H,2-4,7-12H2,1H3,(H,15,18)(H,19,20);/q;;+2/p-2
InChI key: JGUZNLLMUYPEMO-UHFFFAOYSA-L
SMILES: CCCCC=CCC(=O)NCN(CCCO)CC(=O)O[Ca]OC(=O)CN(CCCO)CNC(=O)CC=CCCCC
Systematic name  (3):
  • ビス[N-(3-ヒドロキシプロピル)-N-(3-オクテノイルアミノメチル)グリシン]カルシウム
  • ({2-[(3-ヒドロキシプロピル)[(オクタ-3-エンアミド)メチル]アミノ]アセチル}オキシ)カルシオ 2-[(3-ヒドロキシプロピル)[(オクタ-3-エンアミド)メチル]アミノ]アセタート
  • ({2-[(3-hydroxypropyl)[(oct-3-enamido)methyl]amino]acetyl}oxy)calcio 2-[(3-hydroxypropyl)[(oct-3-enamido)methyl]amino]acetate
Other name (1):
  • Bis[N-(3-hydroxypropyl)-N-(3-octenoylaminomethyl)glycine]calcium salt
Regulation number (1):
  • (2)-1275
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