[(6R,7S,8S,9R)-9-methylsulfonyloxy-7,8-bis(oxidanyl)tetradecan-6-yl] methanesulfonate

Systemtic Name: [(6R,7S,8S,9R)-9-methylsulfonyloxy-7,8-bis(oxidanyl)tetradecan-6-yl] methanesulfonate Openeye Name: [(1R,2S,3S,4R)-2,3-dihydroxy-4-methylsulfonyloxy-1-pentyl-nonyl] methanesulfonate CAS Name: methanesulfonic acid [(6R,7S,8S,9R)-7,8-dihydroxy-9-methylsulfonyloxytetradecan-6-yl] ester IUPAC Name: [(6R,7S,8S,9R)-7,8-dihydroxy-9-methylsulfonyloxytetradecan-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1R,2S,3S,4R)-1-amyl-2,3-dihydroxy-4-methylsulfonyloxy-nonyl] ester Formula: C16H34O8S2 MolecularWeight: 418.56636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C(C(CCCCC)OS(=O)(=O)C)O)O)OS(=O)(=O)C

Isomeric SMILES

CCCCC[C@H]([C@H]([C@@H]([C@@H](CCCCC)OS(=O)(=O)C)O)O)OS(=O)(=O)C

InChI

InChI=1S/C16H34O8S2/c1-5-7-9-11-13(23-25(3,19)20)15(17)16(18)14(12-10-8-6-2)24-26(4,21)22/h13-18H,5-12H2,1-4H3/t13-,14-,15-,16-/m1/s1