sodium 4-oxidanylheptacosanoate

Systemtic Name: sodium 4-oxidanylheptacosanoate Openeye Name: sodium 4-hydroxyheptacosanoate CAS Name: sodium 4-hydroxyheptacosanoate IUPAC Name: sodium 4-hydroxyheptacosanoate Traditional Name: sodium 4-hydroxyheptacosanoate Formula: C27H53NaO3 MolecularWeight: 448.69769

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC(CCC(=O)[O-])O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(CCC(=O)[O-])O.[Na+]

InChI

InChI=1S/C27H54O3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(28)24-25-27(29)30;/h26,28H,2-25H2,1H3,(H,29,30);/q;+1/p-1