[(2R,3R,4R)-16-methyl-1,3,4-tris(oxidanyl)heptadecan-2-yl] methanesulfonate

Systemtic Name: [(2R,3R,4R)-16-methyl-1,3,4-tris(oxidanyl)heptadecan-2-yl] methanesulfonate Openeye Name: [(1R,2R,3R)-2,3-dihydroxy-1-(hydroxymethyl)-15-methyl-hexadecyl] methanesulfonate CAS Name: methanesulfonic acid [(2R,3R,4R)-1,3,4-trihydroxy-16-methylheptadecan-2-yl] ester IUPAC Name: [(2R,3R,4R)-1,3,4-trihydroxy-16-methylheptadecan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1R,2R,3R)-2,3-dihydroxy-15-methyl-1-methylol-hexadecyl] ester Formula: C19H40O6S MolecularWeight: 396.5823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCC(C(C(CO)OS(=O)(=O)C)O)O

Isomeric SMILES

CC(C)CCCCCCCCCCC[C@H]([C@H]([C@@H](CO)OS(=O)(=O)C)O)O

InChI

InChI=1S/C19H40O6S/c1-16(2)13-11-9-7-5-4-6-8-10-12-14-17(21)19(22)18(15-20)25-26(3,23)24/h16-22H,4-15H2,1-3H3/t17-,18-,19-/m1/s1