Molecule ID: 49859558

IUPAC Name: (2E,6E)-9-[(2R)-3,3-dimethyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoate

Description: The molecule is a polyunsaturated fatty acid anion obtained by deprotonation of the carboxy group of juvenile hormone III acid; major species at pH 7.3. It is a conjugate base of a juvenile hormone III acid.

SMILES: C/C(=C\C(=O)[O-])CC/C=C(\C)CC[C@H]1OC1(C)C

SELFIES: [C][/C][=Branch1][#Branch1][=C][\C][=Branch1][C][=O][O-1][C][C][/C][=C][Branch1][C][\C][C][C][C@H1][O][C][Ring1][Ring1][Branch1][C][C][C]

InChI: InChI=1S/C15H24O3/c1-11(8-9-13-15(3,4)18-13)6-5-7-12(2)10-14(16)17/h6,10,13H,5,7-9H2,1-4H3,(H,16,17)/p-1/b11-6+,12-10+/t13-/m1/s1

Molecular Properties:
- Polar Surface Area: 52.7 Ų
- LogP: 4.3