Molecule ID: 126843510

IUPAC Name: 2-[2-[(Z)-4-hydroxypent-2-enyl]-3-oxocyclopentyl]acetate

Description: The molecule is a hydroxy monocarboxylic acid anion that is the conjugate base of 12-hydroxyjasmonic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. It is a 5-oxo monocarboxylic acid anion and a hydroxy monocarboxylic acid anion.

SMILES: CC(O)/C=C\CC1C(=O)CCC1CC(=O)[O-]

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

InChI: InChI=1S/C12H18O4/c1-8(13)3-2-4-10-9(7-12(15)16)5-6-11(10)14/h2-3,8-10,13H,4-7H2,1H3,(H,15,16)/p-1/b3-2-

Molecular Properties:
- Polar Surface Area: 77.4 Ų
- LogP: 1.0