(1Z,4S,6S,12S,15S)-4,12-dimethyl-9-methylidene-15-propan-2-yl-5-oxatricyclo[10.3.0.04,6]pentadec-1-ene-10,14-dione
| Internal ID | d3715421-1d16-47dc-983f-64b3ba635b83 |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Diterpenoids > Dolabellane and neodolabellane diterpenoids |
| IUPAC Name | (1Z,4S,6S,12S,15S)-4,12-dimethyl-9-methylidene-15-propan-2-yl-5-oxatricyclo[10.3.0.04,6]pentadec-1-ene-10,14-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C20H28O3/c1-12(2)18-14-8-9-20(5)17(23-20)7-6-13(3)15(21)10-19(14,4)11-16(18)22/h8,12,17-18H,3,6-7,9-11H2,1-2,4-5H3/b14-8-/t17-,18-,19+,20-/m0/s1 |
| InChI Key | VRQFTDZLAVZHMF-GUIBPOCESA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C20H28O3 |
| Molecular Weight | 316.40 g/mol |
| Exact Mass | 316.20384475 g/mol |
| Topological Polar Surface Area (TPSA) | 46.70 Ų |
| XlogP | 3.00 |
| There are no found synonyms. |
![2D Structure of (1Z,4S,6S,12S,15S)-4,12-dimethyl-9-methylidene-15-propan-2-yl-5-oxatricyclo[10.3.0.04,6]pentadec-1-ene-10,14-dione](https://plantaedb.com/storage/docs/compounds/2023/11/75e0ad50-86d0-11ee-8614-a94cdcf9922c.jpg "2D Structure of (1Z,4S,6S,12S,15S)-4,12-dimethyl-9-methylidene-15-propan-2-yl-5-oxatricyclo[10.3.0.04,6]pentadec-1-ene-10,14-dione")
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 96.31% | 98.95% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 95.45% | 97.25% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 95.33% | 91.11% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 94.31% | 96.77% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.15% | 96.09% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 91.45% | 94.45% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 90.18% | 95.56% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 87.37% | 95.89% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 85.76% | 97.14% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 83.48% | 85.14% |
| CHEMBL1871 | P10275 | Androgen Receptor | 82.57% | 96.43% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 82.39% | 98.33% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 82.33% | 93.40% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 82.01% | 100.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.14% | 99.23% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 81.06% | 97.09% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 80.88% | 89.00% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 80.63% | 96.21% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 80.19% | 90.17% |
| CHEMBL4072 | P07858 | Cathepsin B | 80.08% | 93.67% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
| There are no matching plants. |
| PubChem | 162905992 |
| LOTUS | LTS0134054 |
| wikiData | Q105291915 |