6-(hydroxymethyl)-2-octyl-2-sulfanyl-oxane-3,4,5-triol

Systemtic Name: 6-(hydroxymethyl)-2-octyl-2-sulfanyl-oxane-3,4,5-triol Openeye Name: 6-(hydroxymethyl)-2-octyl-2-sulfanyl-tetrahydropyran-3,4,5-triol CAS Name: 6-(hydroxymethyl)-2-mercapto-2-octyloxane-3,4,5-triol IUPAC Name: 6-(hydroxymethyl)-2-octyl-2-sulfanyloxane-3,4,5-triol Traditional Name: 2-mercapto-6-methylol-2-octyl-tetrahydropyran-3,4,5-triol Formula: C14H28O5S MolecularWeight: 308.43412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C(C(C(C(O1)CO)O)O)O)S

Isomeric SMILES

CCCCCCCCC1(C(C(C(C(O1)CO)O)O)O)S

InChI

InChI=1S/C14H28O5S/c1-2-3-4-5-6-7-8-14(20)13(18)12(17)11(16)10(9-15)19-14/h10-13,15-18,20H,2-9H2,1H3