(5E)-5-[(2Z)-2-[7a-methyl-1-[6-methyl-3-(4-methylphenyl)sulfonyl-5,6-bis(oxidanyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexane-1,3-diol

Systemtic Name: (5E)-5-[(2Z)-2-[7a-methyl-1-[6-methyl-3-(4-methylphenyl)sulfonyl-5,6-bis(oxidanyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexane-1,3-diol Openeye Name: (5E)-5-[(2Z)-2-[1-[4,5-dihydroxy-1,5-dimethyl-2-(p-tolylsulfonyl)hexyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol CAS Name: (5E)-5-[(2Z)-2-[1-[5,6-dihydroxy-6-methyl-3-(4-methylphenyl)sulfonylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylenecyclohexane-1,3-diol IUPAC Name: (5E)-5-[(2Z)-2-[1-[5,6-dihydroxy-6-methyl-3-(4-methylphenyl)sulfonylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol Traditional Name: (5E)-5-[(2Z)-2-[1-(4,5-dihydroxy-1,5-dimethyl-2-tosyl-hexyl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol Formula: C34H50O6S MolecularWeight: 586.8222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C(C)(C)O)O)C(C)C2CCC3C2(CCCC3=CC=C4CC(CC(C4=C)O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C(C)(C)O)O)C(C)C2CCC\3C2(CCC/C3=C/C=C/4\CC(CC(C4=C)O)O)C

InChI

InChI=1S/C34H50O6S/c1-21-9-13-27(14-10-21)41(39,40)31(20-32(37)33(4,5)38)23(3)28-15-16-29-24(8-7-17-34(28,29)6)11-12-25-18-26(35)19-30(36)22(25)2/h9-14,23,26,28-32,35-38H,2,7-8,15-20H2,1,3-6H3/b24-11-,25-12+