2,13,14,24-Tetrahydroxy-11-(1-methoxyethyl)-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.07,15.08,12]octacosa-1,3,18-triene-20,27,28-trione
| Internal ID | fe430347-ee90-4b87-a3ee-0690adda40dc |
| Taxonomy | Phenylpropanoids and polyketides > Macrolactams |
| IUPAC Name | 2,13,14,24-tetrahydroxy-11-(1-methoxyethyl)-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.07,15.08,12]octacosa-1,3,18-triene-20,27,28-trione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H42N2O8/c1-13-11-17-18-12-15-7-8-19(33)25-27(36)26(32-30(25)39)20(34)9-10-31-21(35)6-4-5-16(15)23(18)28(37)29(38)24(17)22(13)14(2)40-3/h4,6-8,13-18,20,22-24,26,28-29,33-34,37-38H,5,9-12H2,1-3H3,(H,31,35)(H,32,39) |
| InChI Key | FIXAZGJDYCUWPO-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C30H42N2O8 |
| Molecular Weight | 558.70 g/mol |
| Exact Mass | 558.29411630 g/mol |
| Topological Polar Surface Area (TPSA) | 165.00 Ų |
| XlogP | 1.50 |
| There are no found synonyms. |
![2D Structure of 2,13,14,24-Tetrahydroxy-11-(1-methoxyethyl)-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.07,15.08,12]octacosa-1,3,18-triene-20,27,28-trione](https://plantaedb.com/storage/docs/compounds/2023/11/64be5ae0-8682-11ee-9727-e56f3924a1e4.jpg "2D Structure of 2,13,14,24-Tetrahydroxy-11-(1-methoxyethyl)-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.07,15.08,12]octacosa-1,3,18-triene-20,27,28-trione")
| 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 | 98.31% | 91.11% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 98.09% | 97.25% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 97.95% | 96.09% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 97.53% | 94.75% |
| CHEMBL2581 | P07339 | Cathepsin D | 97.24% | 98.95% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 96.00% | 85.14% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 95.44% | 97.09% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 95.22% | 94.45% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 93.07% | 96.21% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 91.24% | 90.08% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 90.05% | 91.07% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 89.75% | 93.03% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 89.44% | 100.00% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 87.79% | 82.69% |
| CHEMBL1907605 | P24864 | Cyclin-dependent kinase 2/cyclin E1 | 87.75% | 92.88% |
| CHEMBL5469 | Q14289 | Protein tyrosine kinase 2 beta | 87.12% | 91.03% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 86.91% | 89.00% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 86.64% | 96.77% |
| CHEMBL213 | P08588 | Beta-1 adrenergic receptor | 86.23% | 95.56% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 83.95% | 95.89% |
| CHEMBL3437 | Q16853 | Amine oxidase, copper containing | 83.84% | 94.00% |
| CHEMBL1871 | P10275 | Androgen Receptor | 83.18% | 96.43% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 81.88% | 97.14% |
| CHEMBL3267 | P48736 | PI3-kinase p110-gamma subunit | 81.74% | 95.71% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 80.96% | 90.71% |
| CHEMBL2535 | P11166 | Glucose transporter | 80.88% | 98.75% |
| CHEMBL5255 | O00206 | Toll-like receptor 4 | 80.71% | 92.50% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 80.64% | 99.23% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 80.29% | 99.15% |
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.
| There are no matching plants. |
| PubChem | 162815489 |
| LOTUS | LTS0080662 |
| wikiData | Q103819045 |