Calcium bis(2-{[2-(stearoyloxy)propanoyl]oxy}propanoate)

ChemSpider ID: 20709
Molecular Formula: C₄₈H₈₆CaO₁₂
Average mass: 895.267 Da
Monoisotopic mass: 894.574524 Da
Systematic name

Calcium bis(2-{[2-(stearoyloxy)propanoyl]oxy}propanoate)
SMILES and InChIs

SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(C)C(=O)OC(C)C(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)OC(C)C(=O)OC(C)C(=O)[O-].[Ca+2] Copied

Std. InChI:

InChI=1S/2C24H44O6.Ca/c2*1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)29-21(3)24(28)30-20(2)23(26)27;/h2*20-21H,4-19H2,1-3H3,(H,26,27);/q;;+2/p-2 Copied

Std. InChIKey:

OEUVSBXAMBLPES-UHFFFAOYSA-L Copied
Cite this record
CSID:20709, http://www.chemspider.com/Chemical-Structure.20709.html (accessed 06:52, Feb 28, 2015) Copied

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