sodium 6-(hydroxymethyl)-2-octadecoxysulfonyloxy-4,5-bis(oxidanyl)oxan-3-olate

Systemtic Name: sodium 6-(hydroxymethyl)-2-octadecoxysulfonyloxy-4,5-bis(oxidanyl)oxan-3-olate Openeye Name: sodium 4,5-dihydroxy-6-(hydroxymethyl)-2-octadecoxysulfonyloxy-tetrahydropyran-3-olate CAS Name: sodium 4,5-dihydroxy-6-(hydroxymethyl)-2-octadecoxysulfonyloxy-3-oxanolate IUPAC Name: sodium 4,5-dihydroxy-6-(hydroxymethyl)-2-octadecoxysulfonyloxyoxan-3-olate Traditional Name: sodium 4,5-dihydroxy-6-methylol-2-stearyloxysulfonyloxy-tetrahydropyran-3-olate Formula: C24H47NaO9S MolecularWeight: 534.67935

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOS(=O)(=O)OC1C(C(C(C(O1)CO)O)O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOS(=O)(=O)OC1C(C(C(C(O1)CO)O)O)[O-].[Na+]

InChI

InChI=1S/C24H47O9S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-31-34(29,30)33-24-23(28)22(27)21(26)20(19-25)32-24;/h20-27H,2-19H2,1H3;/q-1;+1