28-oxidanylidene-28-sulfo-octacosanoic acid

Systemtic Name: 28-oxidanylidene-28-sulfo-octacosanoic acid Openeye Name: 28-oxo-28-sulfo-octacosanoic acid CAS Name: 28-oxo-28-sulfooctacosanoic acid IUPAC Name: 28-oxo-28-sulfooctacosanoic acid Traditional Name: 28-keto-28-sulfo-montanic acid Formula: C28H54O6S MolecularWeight: 518.78976

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCCCCCCCCC(=O)S(=O)(=O)O)CCCCCCCCCCCCC(=O)O

Isomeric SMILES

C(CCCCCCCCCCCCCC(=O)S(=O)(=O)O)CCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C28H54O6S/c29-27(30)25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28(31)35(32,33)34/h1-26H2,(H,29,30)(H,32,33,34)