(14S,21Z,29R,30S)-1,16-diazatetracyclo[27.3.1.112,16.014,30]tetratriacont-21-ene
| Internal ID | 8751e19e-dc34-42bd-add3-416bcc39ef14 |
| Taxonomy | Organoheterocyclic compounds > Piperidines |
| IUPAC Name | (14S,21Z,29R,30S)-1,16-diazatetracyclo[27.3.1.112,16.014,30]tetratriacont-21-ene |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C32H58N2/c1-2-5-10-14-18-23-34-26-29-19-15-11-7-4-6-9-13-17-22-33-24-21-32(31(25-29)28-34)30(27-33)20-16-12-8-3-1/h2,5,29-32H,1,3-4,6-28H2/b5-2-/t29?,30-,31+,32-/m0/s1 |
| InChI Key | SPFKMNPQGPXWAJ-PGNWYGCDSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C32H58N2 |
| Molecular Weight | 470.80 g/mol |
| Exact Mass | 470.459999859 g/mol |
| Topological Polar Surface Area (TPSA) | 6.50 Ų |
| XlogP | 10.10 |
| There are no found synonyms. |
![2D Structure of (14S,21Z,29R,30S)-1,16-diazatetracyclo[27.3.1.112,16.014,30]tetratriacont-21-ene](https://plantaedb.com/storage/docs/compounds/2023/11/14s21z29r30s-116-diazatetracyclo27311121601430tetratriacont-21-ene.jpg "2D Structure of (14S,21Z,29R,30S)-1,16-diazatetracyclo[27.3.1.112,16.014,30]tetratriacont-21-ene")
| 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 |
|---|---|---|---|---|
| CHEMBL240 | Q12809 | HERG | 97.86% | 89.76% |
| CHEMBL238 | Q01959 | Dopamine transporter | 96.02% | 95.88% |
| CHEMBL4235 | P28845 | 11-beta-hydroxysteroid dehydrogenase 1 | 95.72% | 97.98% |
| CHEMBL3746 | P80365 | 11-beta-hydroxysteroid dehydrogenase 2 | 95.41% | 94.78% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 95.10% | 97.25% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 94.78% | 96.09% |
| CHEMBL5203 | P33316 | dUTP pyrophosphatase | 91.45% | 99.18% |
| CHEMBL5805 | Q9NR97 | Toll-like receptor 8 | 89.27% | 96.25% |
| CHEMBL2492 | P36544 | Neuronal acetylcholine receptor protein alpha-7 subunit | 88.87% | 88.42% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 87.36% | 95.89% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 87.15% | 97.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 86.44% | 98.95% |
| CHEMBL1968 | P07099 | Epoxide hydrolase 1 | 86.31% | 98.57% |
| CHEMBL6136 | O60341 | Lysine-specific histone demethylase 1 | 85.08% | 95.58% |
| CHEMBL2094108 | P49354 | Protein farnesyltransferase | 84.48% | 97.92% |
| CHEMBL1744525 | P43490 | Nicotinamide phosphoribosyltransferase | 83.84% | 96.25% |
| CHEMBL3023 | Q9NRA0 | Sphingosine kinase 2 | 83.67% | 95.61% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 82.87% | 82.69% |
| CHEMBL4777 | P25929 | Neuropeptide Y receptor type 1 | 82.37% | 96.67% |
| CHEMBL274 | P51681 | C-C chemokine receptor type 5 | 82.09% | 98.77% |
| CHEMBL4361 | Q07820 | Induced myeloid leukemia cell differentiation protein Mcl-1 | 81.96% | 95.52% |
| CHEMBL2693 | Q9UIQ6 | Cystinyl aminopeptidase | 81.82% | 97.64% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 80.65% | 98.33% |
| CHEMBL2073 | P07947 | Tyrosine-protein kinase YES | 80.57% | 83.14% |
| CHEMBL216 | P11229 | Muscarinic acetylcholine receptor M1 | 80.42% | 94.23% |
| CHEMBL3012 | Q13946 | Phosphodiesterase 7A | 80.28% | 99.29% |
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 | 102124133 |
| LOTUS | LTS0191536 |
| wikiData | Q105257393 |