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

Systemtic Name: 3-heptylsulfanyloxy-6-(hydroxymethyl)oxane-2,4,5-triol Openeye Name: 3-heptylsulfanyloxy-6-(hydroxymethyl)tetrahydropyran-2,4,5-triol CAS Name: 1-heptanesulfenic acid IUPAC Name: 3-heptylsulfanyloxy-6-(hydroxymethyl)oxane-2,4,5-triol Traditional Name: 3-(heptylthio)oxy-6-methylol-tetrahydropyran-2,4,5-triol Formula: C13H26O6S MolecularWeight: 310.40694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSOC1C(C(C(OC1O)CO)O)O

Isomeric SMILES

CCCCCCCSOC1C(C(C(OC1O)CO)O)O

InChI

InChI=1S/C13H26O6S/c1-2-3-4-5-6-7-20-19-12-11(16)10(15)9(8-14)18-13(12)17/h9-17H,2-8H2,1H3