methyl 9-[6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]sulfanylnonanoate

Systemtic Name: methyl 9-[6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]sulfanylnonanoate Openeye Name: methyl 9-[4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]sulfanylnonanoate CAS Name: 9-[[4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]thio]nonanoic acid methyl ester IUPAC Name: methyl 9-[4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylnonanoate Traditional Name: 9-[(4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl)thio]pelargonic acid methyl ester Formula: C16H30O6S MolecularWeight: 350.4708

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCSC1CC(C(C(O1)CO)O)O

Isomeric SMILES

COC(=O)CCCCCCCCSC1CC(C(C(O1)CO)O)O

InChI

InChI=1S/C16H30O6S/c1-21-14(19)8-6-4-2-3-5-7-9-23-15-10-12(18)16(20)13(11-17)22-15/h12-13,15-18,20H,2-11H2,1H3