(1R,9R,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadec-2-en-6-one
| Internal ID | 3d813c8b-ab42-4785-8619-379ac37d4c3f |
| Taxonomy | Alkaloids and derivatives > Lupin alkaloids > Sparteine, lupanine, and related alkaloids |
| IUPAC Name | (1R,9R,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadec-2-en-6-one |
| SMILES (Canonical) | C1CCN2CC3CC(C2C1)CN4C3=CCCC4=O |
| SMILES (Isomeric) | C1CCN2C[C@H]3C[C@@H]([C@H]2C1)CN4C3=CCCC4=O |
| InChI | InChI=1S/C15H22N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h5,11-13H,1-4,6-10H2/t11-,12-,13-/m1/s1 |
| InChI Key | GSQQGCZVTAUICD-JHJVBQTASA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C15H22N2O |
| Molecular Weight | 246.35 g/mol |
| Exact Mass | 246.173213330 g/mol |
| Topological Polar Surface Area (TPSA) | 23.60 Ų |
| XlogP | 1.30 |
| There are no found synonyms. |
![2D Structure of (1R,9R,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadec-2-en-6-one](https://plantaedb.com/storage/docs/compounds/2023/11/1r9r10r-715-diazatetracyclo77102701015heptadec-2-en-6-one.jpg "2D Structure of (1R,9R,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadec-2-en-6-one")
| 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 |
|---|---|---|---|---|
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 94.71% | 93.40% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 91.39% | 97.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 91.00% | 95.56% |
| CHEMBL3351 | Q13085 | Acetyl-CoA carboxylase 1 | 87.67% | 93.04% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 87.54% | 97.25% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 87.35% | 94.45% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.91% | 95.89% |
| CHEMBL2581 | P07339 | Cathepsin D | 85.33% | 98.95% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 84.25% | 90.71% |
| CHEMBL2781 | P19634 | Sodium/hydrogen exchanger 1 | 83.77% | 90.24% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 83.52% | 93.03% |
| CHEMBL5255 | O00206 | Toll-like receptor 4 | 83.41% | 92.50% |
| CHEMBL3820 | P35557 | Hexokinase type IV | 82.70% | 91.96% |
| CHEMBL1978 | P11511 | Cytochrome P450 19A1 | 81.77% | 91.76% |
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.
| Clathrotropis glaucophylla |
| Maackia amurensis |
| Sophora chrysophylla |
| Spartium junceum |
| PubChem | 14379239 |
| LOTUS | LTS0143169 |
| wikiData | Q105017578 |