calcium 2-oxidanylpropanoyl 2-methyl-2-oxidanyl-icosanoate

Systemtic Name: calcium 2-oxidanylpropanoyl 2-methyl-2-oxidanyl-icosanoate Openeye Name: calcium 2-hydroxypropanoyl 2-hydroxy-2-methyl-icosanoate CAS Name: calcium 2-hydroxy-2-methyleicosanoic acid (2-hydroxy-1-oxopropyl) ester IUPAC Name: calcium 2-hydroxypropanoyl 2-hydroxy-2-methylicosanoate Traditional Name: calcium 2-hydroxy-2-methyl-arachidic acid lactoyl ester Formula: C24H46CaO5+2 MolecularWeight: 454.69704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H46O5.Ca/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(3,28)23(27)29-22(26)21(2)25;/h21,25,28H,4-20H2,1-3H3;/q;+2