Molecule ID: 5282222

IUPAC Name: (2Z,4E)-5-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]-3-methylpenta-2,4-dienal

Description: The molecule is an apo carotenoid sesquiterpenoid and an enal. It has a role as a plant growth retardant and a plant metabolite.

SMILES: CC(=C/C=O)/C=C/[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C

SELFIES: [C][C][=Branch1][Ring2][=C][/C][=O][/C][=C][/C@@][O][C@][Ring1][Ring1][Branch1][C][C][C][C@@H1][Branch1][C][O][C][C][Ring1][=Branch2][Branch1][C][C][C]

InChI: InChI=1S/C15H22O3/c1-11(6-8-16)5-7-15-13(2,3)9-12(17)10-14(15,4)18-15/h5-8,12,17H,9-10H2,1-4H3/b7-5+,11-6-/t12-,14+,15-/m0/s1

Molecular Properties:
- Polar Surface Area: 49.8 Ų
- LogP: 2.0