1,6-Dihydroxy-4-(2-hydroxy-3-methylbut-3-enyl)-3,5-dimethoxy-10-methylacridin-9-one
| Internal ID | e0caa8da-ea7b-4766-868d-c8431c9936fd |
| Taxonomy | Organoheterocyclic compounds > Quinolines and derivatives > Benzoquinolines > Acridines > Acridones |
| IUPAC Name | 1,6-dihydroxy-4-(2-hydroxy-3-methylbut-3-enyl)-3,5-dimethoxy-10-methylacridin-9-one |
| SMILES (Canonical) | CC(=C)C(CC1=C(C=C(C2=C1N(C3=C(C2=O)C=CC(=C3OC)O)C)O)OC)O |
| SMILES (Isomeric) | CC(=C)C(CC1=C(C=C(C2=C1N(C3=C(C2=O)C=CC(=C3OC)O)C)O)OC)O |
| InChI | InChI=1S/C21H23NO6/c1-10(2)14(24)8-12-16(27-4)9-15(25)17-18(12)22(3)19-11(20(17)26)6-7-13(23)21(19)28-5/h6-7,9,14,23-25H,1,8H2,2-5H3 |
| InChI Key | XPXLXTVQCLZAIS-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C21H23NO6 |
| Molecular Weight | 385.40 g/mol |
| Exact Mass | 385.15253745 g/mol |
| Topological Polar Surface Area (TPSA) | 99.50 Ų |
| XlogP | 3.80 |
| There are no found synonyms. |
| 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 | 97.91% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.60% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.41% | 96.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 94.82% | 95.56% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 94.59% | 94.45% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 93.65% | 85.14% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 93.53% | 89.00% |
| CHEMBL225 | P28335 | Serotonin 2c (5-HT2c) receptor | 92.86% | 89.62% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 91.73% | 94.00% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 90.13% | 86.33% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 89.83% | 93.99% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 89.66% | 91.49% |
| CHEMBL2535 | P11166 | Glucose transporter | 89.63% | 98.75% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 88.85% | 99.15% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 87.10% | 99.17% |
| CHEMBL1255126 | O15151 | Protein Mdm4 | 85.54% | 90.20% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 85.25% | 90.00% |
| CHEMBL2085 | P14174 | Macrophage migration inhibitory factor | 85.13% | 80.78% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 83.63% | 97.21% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 81.83% | 96.00% |
| CHEMBL2378 | P30307 | Dual specificity phosphatase Cdc25C | 81.15% | 96.67% |
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.
| Citrus maxima |
| PubChem | 15627931 |
| LOTUS | LTS0264761 |
| wikiData | Q105339047 |