Chelilutine
| Internal ID | 909d4901-c01b-41e4-953a-ee7a8d83c60c |
| Taxonomy | Alkaloids and derivatives > Benzophenanthridine alkaloids > Quaternary benzophenanthridine alkaloids |
| IUPAC Name | 1,2,4-trimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C22H20NO5/c1-23-10-15-20(18(24-2)9-19(25-3)22(15)26-4)13-6-5-12-7-16-17(28-11-27-16)8-14(12)21(13)23/h5-10H,11H2,1-4H3/q+1 |
| InChI Key | LZJHNXHYKRKCDZ-UHFFFAOYSA-N |
| Popularity | 11 references in papers |
| Molecular Formula | C22H20NO5+ |
| Molecular Weight | 378.40 g/mol |
| Exact Mass | 378.13414774 g/mol |
| Topological Polar Surface Area (TPSA) | 50.00 Ų |
| XlogP | 4.50 |
| C12229 |
| 1,2,4-trimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium |
| AC1L9F2E |
| 55950-32-8 |
| CHEMBL4748098 |
| CHEBI:31390 |
| DTXSID001318159 |
| Q27114299 |
| [1,3]benzodioxolo[5,6-c]phenanthridinium, 1,2,4-trimethoxy-12-methyl- |
| 1,2,4-trimethoxy-12-methyl-[1,3]benzodioxolo[6,5-c]phenanthridin-12-ium |
| 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 |
|---|---|---|---|---|
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 97.58% | 96.77% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 95.40% | 91.11% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 95.28% | 94.45% |
| CHEMBL4481 | P35228 | Nitric oxide synthase, inducible | 92.19% | 94.80% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 91.44% | 94.00% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 90.01% | 92.62% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.44% | 95.56% |
| CHEMBL225 | P28335 | Serotonin 2c (5-HT2c) receptor | 88.70% | 89.62% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 88.58% | 96.00% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 88.07% | 86.33% |
| CHEMBL215 | P09917 | Arachidonate 5-lipoxygenase | 86.62% | 92.68% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 86.33% | 96.09% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 83.50% | 93.99% |
| CHEMBL4306 | P22460 | Voltage-gated potassium channel subunit Kv1.5 | 83.41% | 94.03% |
| CHEMBL2535 | P11166 | Glucose transporter | 82.99% | 98.75% |
| CHEMBL4224 | P49759 | Dual specificty protein kinase CLK1 | 81.96% | 85.30% |
| CHEMBL4225 | P49760 | Dual specificity protein kinase CLK2 | 80.51% | 80.96% |
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.
| Chelidonium majus |
| Eschscholzia californica |
| Sanguinaria canadensis |
| Stylophorum lasiocarpum |
| PubChem | 443720 |
| LOTUS | LTS0192507 |
| wikiData | Q27114299 |