General Characteristics
| NatID | 1034 |
| Common Name | NatID_1034 |
| Molecular Formula | C11H18 |
| Chemical Class | Unsaturated hydrocarbons > Olefins |
| Molecular Weight | 150.141 g/mol |
| Other names |
Representations
| Smiles | C=C/C=C/C=C\CCCCC |
| Inchi | InChI=1S/C11H18/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10H2,2H3/b7-5+,11-9- |
| Inchi Key | JQQDKNVOSLONRS-STRRHFTISA-N |
| 3D Structure |
Calculated Properties
| clogP | 3.87 |
| TPSA | 0.00 |
| HBD | 0 |
| HBA | 0 |
| Rotatable Bonds | 6 |
| Aromatic Rings | 0 |
| Heavy Atoms | 11 |
| Aromatic Carbocycles | 0 |
| Aromatic Heterocycles | 0 |
| Number of NO | 0 |
Experiments
| EID | Source | Semisynthetic? | Confidence level | References |
|---|---|---|---|---|
| 9162 | Aristolochia argentina | No | Very High | Priestap, H. A., van Baren, C. M., Di Leo Lira, P., Coussio, J. D., & Bandoni, A. L. (2003). Volatile constituents of Aristolochia argentina. Phytochemistry, 63(2), 221–225. https://doi.org/10.1016/s0031-9422(02)00751-3 |
| Bioassay ID | NPASS ID | Target | Activity type | Activity |
|---|---|---|---|---|
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