General Characteristics
2D structure
NatID 1298
Common Name NatID_1298
Molecular Formula C15H24
Chemical Class Unsaturated hydrocarbons > Branched unsaturated hydrocarbons
Molecular Weight 204.188 g/mol
Other names

 

Representations
Smiles C=CC1(C)CCC2C(CC2(C)C)C(=C)C1
Inchi InChI=1S/C15H24/c1-6-15(5)8-7-13-12(11(2)9-15)10-14(13,3)4/h6,12-13H,1-2,7-10H2,3-5H3
Inchi Key FITHEODIIYWPLM-UHFFFAOYSA-N
3D Structure

 

Calculated Properties
clogP 4.58
TPSA 0.00
HBD 0
HBA 0
Rotatable Bonds 1
Aromatic Rings 0
Heavy Atoms 15
Aromatic Carbocycles 0
Aromatic Heterocycles 0
Number of NO 0

 

Experiments
EID Source Semisynthetic? Confidence level References
9605 Flourensia oolepis No Very High García, M., Gonzalez-Coloma, A., Donadel, O. J., Ardanaz, C. E., Tonn, C. E., & Sosa, M. E. (2007). Insecticidal effects of Flourensia oolepis Blake (Asteraceae) essential oil. Biochemical Systematics and Ecology, 35(4), 181–187. https://doi.org/10.1016/j.bse.2006.10.009

 

Bioassay ID NPASS ID Target Activity type Activity