Chem
J-GLOBAL ID:200907050706381900   Nikkaji number:J163.590E

Bis(17-benzyloxy-5-acetyloxystearic acid)barium salt

ビス(17-ベンジルオキシ-5-アセチルオキシステアリン酸)バリウム
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: C54H86BaO10
Molecular formula furigana: C54-H86-BA-O10
Molecular weight: 1032.598
InChI: InChI=1S/2C27H44O5.Ba/c2*1-23(31-22-25-17-12-10-13-18-25)16-11-8-6-4-3-5-7-9-14-19-26(32-24(2)28)20-15-21-27(29)30;/h2*10,12-13,17-18,23,26H,3-9,11,14-16,19-22H2,1-2H3,(H,29,30);/q;;+2/p-2
InChI key: KIAQENXZPCGVKK-UHFFFAOYSA-L
SMILES: CC(CCCCCCCCCCCC(CCCC(=O)O[Ba]OC(=O)CCCC(CCCCCCCCCCCC(C)OCc1ccccc1)OC(=O)C)OC(=O)C)OCc1ccccc1
Systematic name  (3):
  • ビス(17-ベンジルオキシ-5-アセチルオキシステアリン酸)バリウム
  • {[5-(アセチルオキシ)-17-(ベンジルオキシ)オクタデカノイル]オキシ}バリオ 5-(アセチルオキシ)-17-(ベンジルオキシ)オクタデカノアート
  • {[5-(acetyloxy)-17-(benzyloxy)octadecanoyl]oxy}bario 5-(acetyloxy)-17-(benzyloxy)octadecanoate
Other name (1):
  • Bis(17-benzyloxy-5-acetyloxystearic acid)barium salt
Regulation number (1):
  • (3)-1026
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