dodecanoate; 2-oxidanyloctadecanoate; 2-oxidanylpropanoate

Systemtic Name: dodecanoate; 2-oxidanyloctadecanoate; 2-oxidanylpropanoate Openeye Name: dodecanoate; 2-hydroxyoctadecanoate; 2-hydroxypropanoate CAS Name: dodecanoate; 2-hydroxyoctadecanoate; 2-hydroxypropanoate IUPAC Name: dodecanoate; 2-hydroxyoctadecanoate; 2-hydroxypropanoate Traditional Name: 2-hydroxystearate; lactate; laurate Formula: C33H63O8-3 MolecularWeight: 587.84852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)[O-])O.CCCCCCCCCCCC(=O)[O-].CC(C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)[O-])O.CCCCCCCCCCCC(=O)[O-].CC(C(=O)[O-])O

InChI

InChI=1S/C18H36O3.C12H24O2.C3H6O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21;1-2-3-4-5-6-7-8-9-10-11-12(13)14;1-2(4)3(5)6/h17,19H,2-16H2,1H3,(H,20,21);2-11H2,1H3,(H,13,14);2,4H,1H3,(H,5,6)/p-3