(2S,3R)-3-ethenyl-3-methyl-6-(6-methylheptan-2-yl)-2-prop-1-en-2-yl-cyclohex-5-ene-1,1,2-triol

Systemtic Name: (2S,3R)-3-ethenyl-3-methyl-6-(6-methylheptan-2-yl)-2-prop-1-en-2-yl-cyclohex-5-ene-1,1,2-triol Openeye Name: (2S,3R)-6-(1,5-dimethylhexyl)-2-isopropenyl-3-methyl-3-vinyl-cyclohex-5-ene-1,1,2-triol CAS Name: (2S,3R)-3-ethenyl-3-methyl-2-(1-methylethenyl)-6-(6-methylheptan-2-yl)cyclohex-5-ene-1,1,2-triol IUPAC Name: (2S,3R)-3-ethenyl-3-methyl-6-(6-methylheptan-2-yl)-2-prop-1-en-2-ylcyclohex-5-ene-1,1,2-triol Traditional Name: (2S,3R)-6-(1,5-dimethylhexyl)-2-isopropenyl-3-methyl-3-vinyl-cyclohex-5-ene-1,1,2-triol Formula: C20H34O3 MolecularWeight: 322.48216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1=CCC(C(C1(O)O)(C(=C)C)O)(C)C=C

Isomeric SMILES

CC(C)CCCC(C)C1=CC[C@]([C@](C1(O)O)(C(=C)C)O)(C)C=C

InChI

InChI=1S/C20H34O3/c1-8-18(7)13-12-17(16(6)11-9-10-14(2)3)20(22,23)19(18,21)15(4)5/h8,12,14,16,21-23H,1,4,9-11,13H2,2-3,5-7H3/t16?,18-,19-/m0/s1