3-methoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,9,10-triol
| Internal ID | f3a98825-56cc-444b-a2c8-d8df1a024aa1 |
| Taxonomy | Alkaloids and derivatives > Protoberberine alkaloids and derivatives |
| IUPAC Name | 3-methoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,9,10-triol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C18H19NO4/c1-23-17-7-11-4-5-19-9-13-10(2-3-15(20)18(13)22)6-14(19)12(11)8-16(17)21/h2-3,7-8,14,20-22H,4-6,9H2,1H3 |
| InChI Key | LMCDPTITCNKVNR-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C18H19NO4 |
| Molecular Weight | 313.30 g/mol |
| Exact Mass | 313.13140809 g/mol |
| Topological Polar Surface Area (TPSA) | 73.20 Ų |
| XlogP | 2.30 |
| There are no found synonyms. |
![2D Structure of 3-methoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,9,10-triol](https://plantaedb.com/storage/docs/compounds/2023/11/3-methoxy-681313a-tetrahydro-5h-isoquinolino21-bisoquinoline-2910-triol.jpg "2D Structure of 3-methoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,9,10-triol")
| 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 |
|---|---|---|---|---|
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.59% | 96.09% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 98.20% | 91.11% |
| CHEMBL217 | P14416 | Dopamine D2 receptor | 96.56% | 95.62% |
| CHEMBL2041 | P07949 | Tyrosine-protein kinase receptor RET | 94.72% | 91.79% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 93.49% | 85.14% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 92.63% | 92.94% |
| CHEMBL2056 | P21728 | Dopamine D1 receptor | 92.62% | 91.00% |
| CHEMBL225 | P28335 | Serotonin 2c (5-HT2c) receptor | 92.16% | 89.62% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 92.01% | 86.33% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 91.98% | 94.45% |
| CHEMBL3438 | Q05513 | Protein kinase C zeta | 90.89% | 88.48% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 90.38% | 95.89% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.30% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 88.95% | 98.95% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 87.56% | 93.40% |
| CHEMBL2535 | P11166 | Glucose transporter | 87.15% | 98.75% |
| CHEMBL5469 | Q14289 | Protein tyrosine kinase 2 beta | 85.39% | 91.03% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 84.15% | 90.71% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 83.92% | 90.00% |
| CHEMBL2069156 | Q14145 | Kelch-like ECH-associated protein 1 | 82.39% | 82.38% |
| CHEMBL2146302 | O94925 | Glutaminase kidney isoform, mitochondrial | 81.94% | 100.00% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 81.85% | 93.99% |
| CHEMBL5747 | Q92793 | CREB-binding protein | 81.12% | 95.12% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 80.17% | 99.17% |
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.
| Corydalis saxicola |
| PubChem | 144020841 |
| LOTUS | LTS0058324 |
| wikiData | Q105153846 |