Molecule ID: 9922008

IUPAC Name: 5-[(E)-dodec-1-enyl]-1,3-benzodioxole

Description: The molecule is a member of the class of benzodioxoles that is 1,3-benzodioxole in which the hydrogen at position 5 has been replaced by a dodec-1-en-1-yl group. It has a role as a plant metabolite and an EC 3.2.1.20 (alpha-glucosidase) inhibitor. It is a member of benzodioxoles and an olefinic compound.

SMILES: CCCCCCCCCC/C=C/c1ccc2c(c1)OCO2

SELFIES: [C][C][C][C][C][C][C][C][C][C][/C][=C][/C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1]

InChI: InChI=1S/C19H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-14-18-19(15-17)21-16-20-18/h11-15H,2-10,16H2,1H3/b12-11+

Molecular Properties:
- Polar Surface Area: 18.5 Ų
- LogP: 7.9