Napyradiomycin Cnq525.510B
| Internal ID | 78404235-45df-4a28-963e-3da3808b3bde |
| Taxonomy | Organoheterocyclic compounds > Naphthopyrans > Naphthopyranones |
| IUPAC Name | (3R,4aR,10aS)-3,4a-dichloro-6,8-dihydroxy-2,2,7-trimethyl-10a-[[(1S,2S,4R)-1,3,3-trimethyl-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]-3,4-dihydrobenzo[g]chromene-5,10-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C26H32Cl2O6/c1-12-14(29)9-13-18(19(12)30)21(32)25(28)11-16(27)23(4,5)34-26(25,20(13)31)10-15-22(2,3)17-7-8-24(15,6)33-17/h9,15-17,29-30H,7-8,10-11H2,1-6H3/t15-,16+,17+,24-,25-,26-/m0/s1 |
| InChI Key | NLSPRIUKOHATQS-VCQHOALXSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C26H32Cl2O6 |
| Molecular Weight | 511.40 g/mol |
| Exact Mass | 510.1575941 g/mol |
| Topological Polar Surface Area (TPSA) | 93.10 Ų |
| XlogP | 5.30 |
| CHEMBL3104839 |
| 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 |
|---|---|---|---|---|
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 99.68% | 91.11% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 94.86% | 96.21% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 94.57% | 95.56% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 94.35% | 91.49% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 93.90% | 89.00% |
| CHEMBL240 | Q12809 | HERG | 93.14% | 89.76% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 92.70% | 96.95% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 92.49% | 97.09% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 92.14% | 99.15% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 91.20% | 86.33% |
| CHEMBL2581 | P07339 | Cathepsin D | 91.13% | 98.95% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 90.37% | 95.89% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 88.06% | 89.34% |
| CHEMBL5966 | P55899 | IgG receptor FcRn large subunit p51 | 86.56% | 90.93% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 86.41% | 91.07% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 86.08% | 94.75% |
| CHEMBL259 | P32245 | Melanocortin receptor 4 | 84.08% | 95.38% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 83.30% | 96.09% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 82.91% | 100.00% |
| CHEMBL3922 | P50579 | Methionine aminopeptidase 2 | 82.10% | 97.28% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 82.01% | 94.00% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 81.19% | 92.94% |
| CHEMBL5469 | Q14289 | Protein tyrosine kinase 2 beta | 80.84% | 91.03% |
| CHEMBL2553 | Q15418 | Ribosomal protein S6 kinase alpha 1 | 80.27% | 85.11% |
| CHEMBL2335 | P42785 | Lysosomal Pro-X carboxypeptidase | 80.08% | 100.00% |
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.
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| There are no matching plants. |
| PubChem | 76324767 |
| LOTUS | LTS0181693 |
| wikiData | Q105181545 |