Okaramine H_120150
| Internal ID | 7fdf58f9-16c5-4eab-9f8c-734e9ea79a37 |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives > Pyrroloindoles |
| IUPAC Name | (1Z,4R,12S,14S,17Z)-12-hydroxy-19,19-dimethyl-7-(3-methylbut-2-enyl)-3,5,16,21-tetrazaheptacyclo[14.13.0.03,14.04,12.06,11.020,28.022,27]nonacosa-1(29),6,8,10,17,20(28),22,24,26-nonaene-2,15-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C32H32N4O3/c1-18(2)12-13-19-8-7-10-22-26(19)34-30-32(22,39)17-25-28(37)35-15-14-31(3,4)27-21(16-24(35)29(38)36(25)30)20-9-5-6-11-23(20)33-27/h5-12,14-16,25,30,33-34,39H,13,17H2,1-4H3/b15-14-,24-16-/t25-,30+,32-/m0/s1 |
| InChI Key | CNTMYVFPLVDMFY-HIVUMZBNSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C32H32N4O3 |
| Molecular Weight | 520.60 g/mol |
| Exact Mass | 520.24744090 g/mol |
| Topological Polar Surface Area (TPSA) | 88.70 Ų |
| XlogP | 5.40 |
| 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 |
|---|---|---|---|---|
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 99.40% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.29% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 97.30% | 98.95% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 97.20% | 94.45% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 96.75% | 85.14% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 94.44% | 97.09% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 93.55% | 90.17% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 93.44% | 91.49% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 92.70% | 95.56% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 92.12% | 88.56% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 91.46% | 86.33% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 91.14% | 99.23% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 90.54% | 98.59% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 89.77% | 100.00% |
| CHEMBL3524 | P56524 | Histone deacetylase 4 | 89.39% | 92.97% |
| CHEMBL3430907 | Q96GD4 | Aurora kinase B/Inner centromere protein | 88.93% | 97.50% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 87.47% | 93.99% |
| CHEMBL1902 | P62942 | FK506-binding protein 1A | 86.40% | 97.05% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 85.81% | 95.89% |
| CHEMBL240 | Q12809 | HERG | 84.97% | 89.76% |
| CHEMBL213 | P08588 | Beta-1 adrenergic receptor | 84.46% | 95.56% |
| CHEMBL2095226 | P05556 | Integrin alpha-5/beta-1 | 84.19% | 96.39% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 83.06% | 97.25% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 82.39% | 89.00% |
| CHEMBL5028 | O14672 | ADAM10 | 80.30% | 97.50% |
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 | 100990559 |
| LOTUS | LTS0099144 |
| wikiData | Q104966330 |