methyl (2E,6E,10S,11S)-3,7,11-trimethyl-10-methylsulfonyloxy-11-oxidanyl-trideca-2,6-dienoate

Systemtic Name: methyl (2E,6E,10S,11S)-3,7,11-trimethyl-10-methylsulfonyloxy-11-oxidanyl-trideca-2,6-dienoate Openeye Name: methyl (2E,6E,10S,11S)-11-hydroxy-3,7,11-trimethyl-10-methylsulfonyloxy-trideca-2,6-dienoate CAS Name: (2E,6E,10S,11S)-11-hydroxy-3,7,11-trimethyl-10-methylsulfonyloxytrideca-2,6-dienoic acid methyl ester IUPAC Name: methyl (2E,6E,10S,11S)-11-hydroxy-3,7,11-trimethyl-10-methylsulfonyloxytrideca-2,6-dienoate Traditional Name: (2E,6E,10S,11S)-11-hydroxy-3,7,11-trimethyl-10-methylsulfonyloxy-trideca-2,6-dienoic acid methyl ester Formula: C18H32O6S MolecularWeight: 376.50808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(CCC(=CCCC(=CC(=O)OC)C)C)OS(=O)(=O)C)O

Isomeric SMILES

CC[C@@](C)([C@H](CC/C(=C/CC/C(=C/C(=O)OC)/C)/C)OS(=O)(=O)C)O

InChI

InChI=1S/C18H32O6S/c1-7-18(4,20)16(24-25(6,21)22)12-11-14(2)9-8-10-15(3)13-17(19)23-5/h9,13,16,20H,7-8,10-12H2,1-6H3/b14-9+,15-13+/t16-,18-/m0/s1