NatID | 1297 |
Common Name | NatID_1297 |
Molecular Formula | C15H24O |
Chemical Class | Prenol lipids > Sesquiterpenoids |
Molecular Weight | 220.183 g/mol |
Other names |
Smiles | CC1=CC[C@@]23C[C@@H]1[C@@](C)(CO)[C@@H]2CC[C@H]3C |
Inchi | InChI=1S/C15H24O/c1-10-6-7-15-8-12(10)14(3,9-16)13(15)5-4-11(15)2/h6,11-13,16H,4-5,7-9H2,1-3H3/t11-,12+,13+,14-,15+/m1/s1 |
Inchi Key | PPTXKCYXNDLKTQ-FQKPHLNHSA-N |
3D Structure |
clogP | 3.39 |
TPSA | 20.23 |
HBD | 1 |
HBA | 1 |
Rotatable Bonds | 1 |
Aromatic Rings | 0 |
Heavy Atoms | 16 |
Aromatic Carbocycles | 0 |
Aromatic Heterocycles | 0 |
Number of NO | 1 |
EID | Source | Semisynthetic? | Confidence level | References |
---|---|---|---|---|
9604 | 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 |
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