methyl 2-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-2-sulfanyl-butanoate

Systemtic Name: methyl 2-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-2-sulfanyl-butanoate Openeye Name: methyl 2-sulfanyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]butanoate CAS Name: 2-mercapto-2-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]butanoic acid methyl ester IUPAC Name: methyl 2-sulfanyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]butanoate Traditional Name: 2-mercapto-2-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)butyric acid methyl ester Formula: C11H20O7S MolecularWeight: 296.3373

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1C(C(C(C(O1)CO)O)O)O)(C(=O)OC)S

Isomeric SMILES

CCC(C1C(C(C(C(O1)CO)O)O)O)(C(=O)OC)S

InChI

InChI=1S/C11H20O7S/c1-3-11(19,10(16)17-2)9-8(15)7(14)6(13)5(4-12)18-9/h5-9,12-15,19H,3-4H2,1-2H3