Molecule ID: 66559276

IUPAC Name: 4-methyl-2-[(1Z,3E)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienoxy]-2H-furan-5-one

Description: The molecule is a gamma-lactone that is furan-2(5H)-one which is substituted by a methyl group at position 3 and by a [(1Z,3E)-2-methyl-4-(2,6,6-trimethylcyclohex-1-en-1-yl)buta-1,3-dien-1-yl]oxy group at position 5. It has a role as a plant hormone. It is a gamma-lactone and a cyclic acetal.

SMILES: CC1=CC(O/C=C(C)\C=C\C2=C(C)CCCC2(C)C)OC1=O

SELFIES: [C][C][=C][C][Branch2][Ring1][Branch2][O][/C][=C][Branch1][C][C][\C][=C][\C][=C][Branch1][C][C][C][C][C][C][Ring1][#Branch1][Branch1][C][C][C][O][C][Ring2][Ring1][Ring2][=O]

InChI: InChI=1S/C19H26O3/c1-13(12-21-17-11-15(3)18(20)22-17)8-9-16-14(2)7-6-10-19(16,4)5/h8-9,11-12,17H,6-7,10H2,1-5H3/b9-8+,13-12-

Molecular Properties:
- Polar Surface Area: 35.5 Ų
- LogP: 5.0