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

Systemtic Name: 6-(hydroxymethyl)-3-octylsulfanyloxy-4,5-bis(oxidanyl)oxan-2-olate Openeye Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-octylsulfanyloxy-tetrahydropyran-2-olate CAS Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-(octylthio)oxy-2-oxanolate IUPAC Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-octylsulfanyloxyoxan-2-olate Traditional Name: 4,5-dihydroxy-6-methylol-3-(octylthio)oxy-tetrahydropyran-2-olate Formula: C14H27O6S- MolecularWeight: 323.42558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSOC1C(C(C(OC1[O-])CO)O)O

Isomeric SMILES

CCCCCCCCSOC1C(C(C(OC1[O-])CO)O)O

InChI

InChI=1S/C14H27O6S/c1-2-3-4-5-6-7-8-21-20-13-12(17)11(16)10(9-15)19-14(13)18/h10-17H,2-9H2,1H3/q-1