8,9,10,12-Tetrahydroxy-7,19,26-trimethyl-1-azacyclohexacosa-3,5,13,15,17,19,21,23-octaen-2-one
| Internal ID | d815c1fa-794c-4bea-b77a-0439ca8d67e3 |
| Taxonomy | Phenylpropanoids and polyketides > Macrolactams |
| IUPAC Name | 8,9,10,12-tetrahydroxy-7,19,26-trimethyl-1-azacyclohexacosa-3,5,13,15,17,19,21,23-octaen-2-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C28H39NO5/c1-21-14-8-4-6-10-17-23(3)29-26(32)19-13-12-16-22(2)27(33)28(34)25(31)20-24(30)18-11-7-5-9-15-21/h4-16,18-19,22-25,27-28,30-31,33-34H,17,20H2,1-3H3,(H,29,32) |
| InChI Key | INFZKNGDHJIHQW-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C28H39NO5 |
| Molecular Weight | 469.60 g/mol |
| Exact Mass | 469.28282334 g/mol |
| Topological Polar Surface Area (TPSA) | 110.00 Ų |
| XlogP | 4.30 |
| 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 |
|---|---|---|---|---|
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 97.87% | 83.82% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 96.81% | 97.25% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.98% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 91.68% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 91.01% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 90.88% | 95.56% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 89.08% | 100.00% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 87.22% | 97.09% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 87.02% | 90.08% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 86.61% | 94.75% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 83.62% | 89.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 83.61% | 99.23% |
| CHEMBL1907602 | P06493 | Cyclin-dependent kinase 1/cyclin B1 | 83.08% | 91.24% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 81.65% | 93.03% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 81.05% | 88.56% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 80.32% | 90.71% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 80.29% | 90.00% |
| CHEMBL4803 | P29474 | Nitric-oxide synthase, endothelial | 80.21% | 86.00% |
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.
To see more specific details click the taxa you are interested in.
| There are no matching plants. |
| PubChem | 163062840 |
| LOTUS | LTS0067713 |
| wikiData | Q104168942 |