Actinoramide E
| Internal ID | b8cfc335-b03d-4ed6-9b4c-bc76dab7e11c |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Leucine and derivatives |
| IUPAC Name | (3S)-2-[(2R,3R)-3-hydroxy-2-[(2-methoxyacetyl)amino]-4-methylpentanoyl]-N-[(2S,3S,4S)-3-hydroxy-4-methyl-5-oxo-5-[[(3R)-2-oxopyrrolidin-3-yl]amino]-1-phenylpentan-2-yl]-4,5-dihydro-3H-pyridazine-3-carboxamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H44N6O8/c1-17(2)25(38)24(35-23(37)16-44-4)30(43)36-22(11-8-13-32-36)29(42)34-21(15-19-9-6-5-7-10-19)26(39)18(3)27(40)33-20-12-14-31-28(20)41/h5-7,9-10,13,17-18,20-22,24-26,38-39H,8,11-12,14-16H2,1-4H3,(H,31,41)(H,33,40)(H,34,42)(H,35,37)/t18-,20+,21-,22-,24+,25+,26-/m0/s1 |
| InChI Key | AFIGUHJLNOWSNK-DNMAVYRHSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C30H44N6O8 |
| Molecular Weight | 616.70 g/mol |
| Exact Mass | 616.32206238 g/mol |
| Topological Polar Surface Area (TPSA) | 199.00 Ų |
| XlogP | 0.20 |
| 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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 99.88% | 98.95% |
| CHEMBL4072 | P07858 | Cathepsin B | 98.40% | 93.67% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.04% | 96.09% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 93.83% | 97.09% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 93.47% | 85.14% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 93.16% | 94.45% |
| CHEMBL2693 | Q9UIQ6 | Cystinyl aminopeptidase | 91.09% | 97.64% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 90.69% | 93.03% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 90.51% | 98.33% |
| CHEMBL2094135 | Q96BI3 | Gamma-secretase | 89.26% | 98.05% |
| CHEMBL2535 | P11166 | Glucose transporter | 88.83% | 98.75% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 88.43% | 98.59% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 88.37% | 97.14% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 86.71% | 90.17% |
| CHEMBL4588 | P22894 | Matrix metalloproteinase 8 | 85.13% | 94.66% |
| CHEMBL2563 | Q9UQL6 | Histone deacetylase 5 | 84.80% | 89.67% |
| CHEMBL4979 | P13866 | Sodium/glucose cotransporter 1 | 84.47% | 98.24% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 84.12% | 99.17% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 82.64% | 90.08% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 82.02% | 95.89% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.60% | 99.23% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 81.36% | 82.69% |
| CHEMBL1255126 | O15151 | Protein Mdm4 | 81.20% | 90.20% |
| CHEMBL5028 | O14672 | ADAM10 | 81.09% | 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 | 139586576 |
| LOTUS | LTS0080729 |
| wikiData | Q77509449 |