Formicamycin C
| Internal ID | b21213ce-563d-4719-a5c0-80cdbd07d733 |
| Taxonomy | Benzenoids > Tetralins |
| IUPAC Name | (5aR,11aR)-1,10-dichloro-7-(2,4-dimethoxy-6-methylphenyl)-2,4,5a-trihydroxy-9-methoxy-12,12-dimethyl-11,11a-dihydrotetracene-5,6-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H28Cl2O8/c1-12-7-13(38-4)8-18(39-5)21(12)14-9-19(40-6)25(31)15-10-20-29(2,3)24-23(16(33)11-17(34)26(24)32)28(36)30(20,37)27(35)22(14)15/h7-9,11,20,33-34,37H,10H2,1-6H3/t20-,30-/m1/s1 |
| InChI Key | BDNWOBBVDVIJGL-PRAQEBQASA-N |
| Popularity | 3 references in papers |
| Molecular Formula | C30H28Cl2O8 |
| Molecular Weight | 587.40 g/mol |
| Exact Mass | 586.1161232 g/mol |
| Topological Polar Surface Area (TPSA) | 123.00 Ų |
| XlogP | 6.80 |
| CHEMBL4646535 |
| 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 | 99.33% | 91.11% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 95.90% | 99.15% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 95.64% | 95.56% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 94.40% | 86.33% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 92.32% | 83.82% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 92.25% | 93.99% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 91.55% | 94.75% |
| CHEMBL2535 | P11166 | Glucose transporter | 91.42% | 98.75% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 91.24% | 97.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 91.22% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 91.00% | 96.09% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 90.89% | 95.89% |
| CHEMBL2056 | P21728 | Dopamine D1 receptor | 89.79% | 91.00% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 89.69% | 90.00% |
| CHEMBL2094127 | P06493 | Cyclin-dependent kinase 1/cyclin B | 89.52% | 96.00% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 88.80% | 94.45% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 87.09% | 96.77% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 87.06% | 94.00% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 86.65% | 93.40% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 86.49% | 91.07% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 86.43% | 96.95% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 86.02% | 92.94% |
| CHEMBL2337 | P48067 | Glycine transporter 1 | 84.11% | 95.45% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 83.40% | 97.14% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 83.03% | 93.31% |
| CHEMBL4805 | Q99572 | P2X purinoceptor 7 | 82.69% | 97.50% |
| CHEMBL215 | P09917 | Arachidonate 5-lipoxygenase | 82.55% | 92.68% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 82.34% | 92.62% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 82.28% | 91.19% |
| CHEMBL3492 | P49721 | Proteasome Macropain subunit | 81.89% | 90.24% |
| CHEMBL2335 | P42785 | Lysosomal Pro-X carboxypeptidase | 81.88% | 100.00% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 81.55% | 85.14% |
| CHEMBL3180 | O00748 | Carboxylesterase 2 | 81.10% | 90.00% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 80.42% | 93.03% |
| CHEMBL4145 | Q9UKV0 | Histone deacetylase 9 | 80.24% | 85.49% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 80.00% | 89.00% |
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 | 146684583 |
| LOTUS | LTS0212651 |
| wikiData | Q104924482 |