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

Systemtic Name: 2-(hydroxymethyl)-6-(phenylmethylsulfanyl)oxane-3,4,5-triol Openeye Name: 2-benzylsulfanyl-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: 2-(hydroxymethyl)-6-(phenylmethylthio)oxane-3,4,5-triol IUPAC Name: 2-benzylsulfanyl-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: 2-(benzylthio)-6-methylol-tetrahydropyran-3,4,5-triol Formula: C13H18O5S MolecularWeight: 286.34402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2C(C(C(C(O2)CO)O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CSC2C(C(C(C(O2)CO)O)O)O

InChI

InChI=1S/C13H18O5S/c14-6-9-10(15)11(16)12(17)13(18-9)19-7-8-4-2-1-3-5-8/h1-5,9-17H,6-7H2