2-(hydroxymethyl)-5-(4-methylphenoxy)-6-sulfanyl-oxane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-(4-methylphenoxy)-6-sulfanyl-oxane-3,4-diol Openeye Name: 2-(hydroxymethyl)-5-(4-methylphenoxy)-6-sulfanyl-tetrahydropyran-3,4-diol CAS Name: 2-(hydroxymethyl)-6-mercapto-5-(4-methylphenoxy)oxane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-(4-methylphenoxy)-6-sulfanyloxane-3,4-diol Traditional Name: 6-mercapto-2-methylol-5-(4-methylphenoxy)tetrahydropyran-3,4-diol Formula: C13H18O5S MolecularWeight: 286.34402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2C(C(C(OC2S)CO)O)O

Isomeric SMILES

CC1=CC=C(C=C1)OC2C(C(C(OC2S)CO)O)O

InChI

InChI=1S/C13H18O5S/c1-7-2-4-8(5-3-7)17-12-11(16)10(15)9(6-14)18-13(12)19/h2-5,9-16,19H,6H2,1H3