11-Imino-9-propyl-10-oxa-6,8,12-triazatetracyclo[6.6.1.02,6.012,15]pentadecan-7-one
| Internal ID | 6a66b963-f284-4f77-b70e-da60b2706657 |
| Taxonomy | Organoheterocyclic compounds > Pyrrolopyrimidines |
| IUPAC Name | 11-imino-9-propyl-10-oxa-6,8,12-triazatetracyclo[6.6.1.02,6.012,15]pentadecan-7-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C14H22N4O2/c1-2-4-11-18-12-9(6-8-17(12)13(15)20-11)10-5-3-7-16(10)14(18)19/h9-12,15H,2-8H2,1H3 |
| InChI Key | IKMGOIWAYGIDQL-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C14H22N4O2 |
| Molecular Weight | 278.35 g/mol |
| Exact Mass | 278.17427596 g/mol |
| Topological Polar Surface Area (TPSA) | 59.90 Ų |
| XlogP | 1.80 |
| There are no found synonyms. |
![2D Structure of 11-Imino-9-propyl-10-oxa-6,8,12-triazatetracyclo[6.6.1.02,6.012,15]pentadecan-7-one](https://plantaedb.com/storage/docs/compounds/2023/11/11-imino-9-propyl-10-oxa-6812-triazatetracyclo66102601215pentadecan-7-one.jpg "2D Structure of 11-Imino-9-propyl-10-oxa-6,8,12-triazatetracyclo[6.6.1.02,6.012,15]pentadecan-7-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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 97.29% | 98.95% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 97.05% | 97.25% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.31% | 96.09% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 88.19% | 97.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 86.94% | 95.56% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 85.43% | 85.14% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 84.75% | 95.89% |
| CHEMBL5203 | P33316 | dUTP pyrophosphatase | 82.64% | 99.18% |
| CHEMBL4187 | Q99250 | Sodium channel protein type II alpha subunit | 81.57% | 95.50% |
| CHEMBL1871 | P10275 | Androgen Receptor | 81.42% | 96.43% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 81.20% | 90.17% |
| CHEMBL2140 | P48775 | Tryptophan 2,3-dioxygenase | 81.07% | 98.46% |
| CHEMBL2189110 | Q15910 | Histone-lysine N-methyltransferase EZH2 | 80.83% | 97.50% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 80.63% | 89.63% |
| CHEMBL2781 | P19634 | Sodium/hydrogen exchanger 1 | 80.06% | 90.24% |
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.
| Fissistigma oldhamii |
| PubChem | 73097475 |
| LOTUS | LTS0132222 |
| wikiData | Q105114787 |