[(2S,5R,6R,9S)-6-(4-methylphenyl)sulfonyloxy-1,2,9,10-tetrakis(oxidanyl)decan-5-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2S,5R,6R,9S)-6-(4-methylphenyl)sulfonyloxy-1,2,9,10-tetrakis(oxidanyl)decan-5-yl] 4-methylbenzenesulfonate Openeye Name: [(1R,2R,5S)-1-[(3S)-3,4-dihydroxybutyl]-5,6-dihydroxy-2-(p-tolylsulfonyloxy)hexyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,5R,6R,9S)-1,2,9,10-tetrahydroxy-6-(4-methylphenyl)sulfonyloxydecan-5-yl] ester IUPAC Name: [(2S,5R,6R,9S)-1,2,9,10-tetrahydroxy-6-(4-methylphenyl)sulfonyloxydecan-5-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1R,2R,5S)-1-[(3S)-3,4-dihydroxybutyl]-5,6-dihydroxy-2-tosyloxy-hexyl] ester Formula: C24H34O10S2 MolecularWeight: 546.65076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(CCC(CO)O)C(CCC(CO)O)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H](CC[C@@H](CO)O)[C@@H](CC[C@@H](CO)O)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C24H34O10S2/c1-17-3-9-21(10-4-17)35(29,30)33-23(13-7-19(27)15-25)24(14-8-20(28)16-26)34-36(31,32)22-11-5-18(2)6-12-22/h3-6,9-12,19-20,23-28H,7-8,13-16H2,1-2H3/t19-,20-,23+,24+/m0/s1