NatID | 992 |
Common Name | NatID_992 |
Molecular Formula | C15H24 |
Chemical Class | Prenol lipids > Sesquiterpenoids |
Molecular Weight | 204.188 g/mol |
Other names |
Smiles | C=C(C)[C@@H]1CC[C@@]2(C)CCC=C(C)[C@@H]2C1 |
Inchi | InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h6,13-14H,1,5,7-10H2,2-4H3/t13-,14+,15-/m1/s1 |
Inchi Key | OZQAPQSEYFAMCY-QLFBSQMISA-N |
3D Structure |
clogP | 4.73 |
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 |
EID | Source | Semisynthetic? | Confidence level | References |
---|---|---|---|---|
9090 | Xenophyllum incisum | No | Very High | de Marchese, M. J. A., Heluani, C. S. de, Catalán, C. A. N., Griffin, C. A., Vaughn, J. B., & Herz, W. (2007). Incisol, an alcohol with a novel sesquiterpene skeleton from Xenophyllum incisum. Biochemical Systematics and Ecology, 35(3), 169–175. https://doi.org/10.1016/j.bse.2006.10.006 |
Bioassay ID | NPASS ID | Target | Activity type | Activity |
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