(1E,5E,8S,11E)-11-(hydroxymethyl)-5-methyl-8-prop-1-en-2-yl-cyclotetradeca-1,5,11-triene-1-carboxylate

Systemtic Name: (1E,5E,8S,11E)-11-(hydroxymethyl)-5-methyl-8-prop-1-en-2-yl-cyclotetradeca-1,5,11-triene-1-carboxylate Openeye Name: (1E,5E,8S,11E)-11-(hydroxymethyl)-8-isopropenyl-5-methyl-cyclotetradeca-1,5,11-triene-1-carboxylate CAS Name: (1E,5E,8S,11E)-11-(hydroxymethyl)-5-methyl-8-(1-methylethenyl)-1-cyclotetradeca-1,5,11-trienecarboxylate IUPAC Name: (1E,5E,8S,11E)-11-(hydroxymethyl)-5-methyl-8-prop-1-en-2-ylcyclotetradeca-1,5,11-triene-1-carboxylate Traditional Name: (1E,5E,8S,11E)-8-isopropenyl-5-methyl-11-methylol-cyclotetradeca-1,5,11-triene-1-carboxylate Formula: C20H29O3- MolecularWeight: 317.44246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CCC(=CCCC(=CCC1)C(=O)[O-])CO)C(=C)C

Isomeric SMILES

C/C/1=C\C[C@H](CC/C(=C\CC/C(=C\CC1)/C(=O)[O-])/CO)C(=C)C

InChI

InChI=1S/C20H30O3/c1-15(2)18-12-10-16(3)6-4-8-19(20(22)23)9-5-7-17(14-21)11-13-18/h7-8,10,18,21H,1,4-6,9,11-14H2,2-3H3,(H,22,23)/p-1/b16-10+,17-7+,19-8+/t18-/m1/s1