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calcium 2-hexadecanoyloxypropanoate

calcium 2-hexadecanoyloxypropanoate

Systemtic Name:calcium 2-hexadecanoyloxypropanoate
Openeye Name:calcium 2-hexadecanoyloxypropanoate
CAS Name:calcium 2-(1-oxohexadecoxy)propanoate
IUPAC Name:calcium 2-hexadecanoyloxypropanoate
Traditional Name:calcium 2-hexadecanoyloxypropionate
Formula: C38H70CaO8
MolecularWeight: 695.0356
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/2C19H36O4.Ca/c2*1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20)23-17(2)19(21)22;/h2*17H,3-16H2,1-2H3,(H,21,22);/q;;+2/p-2


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