Me-DL-Val-DL-N(Me)Val-DL-N(Me)Val-DL-N(Me)Val-DL-N(Me)Val-DL-N(Me)Phe-DL-N(Me)Val-NH2
| Internal ID | 1494909b-a07e-4381-90ec-6ceefcce95a4 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides |
| IUPAC Name | N-[1-[[1-[[1-[[1-[[1-[(1-amino-3-methyl-1-oxobutan-2-yl)-methylamino]-1-oxo-3-phenylpropan-2-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]-N,3-dimethyl-2-(methylamino)butanamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C46H80N8O7/c1-26(2)34(48-13)42(57)51(16)37(29(7)8)44(59)53(18)39(31(11)12)46(61)54(19)38(30(9)10)45(60)52(17)36(28(5)6)43(58)49(14)33(25-32-23-21-20-22-24-32)41(56)50(15)35(27(3)4)40(47)55/h20-24,26-31,33-39,48H,25H2,1-19H3,(H2,47,55) |
| InChI Key | JJEUMQYBLIJFIN-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C46H80N8O7 |
| Molecular Weight | 857.20 g/mol |
| Exact Mass | 856.61499692 g/mol |
| Topological Polar Surface Area (TPSA) | 177.00 Ų |
| XlogP | 6.10 |
| 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 | 98.76% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 97.83% | 96.09% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 95.33% | 90.17% |
| CHEMBL3492 | P49721 | Proteasome Macropain subunit | 93.77% | 90.24% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 90.69% | 95.56% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 88.09% | 99.17% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 86.78% | 95.50% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 86.35% | 100.00% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 85.48% | 94.73% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 84.34% | 90.00% |
| CHEMBL3004 | P33527 | Multidrug resistance-associated protein 1 | 81.37% | 96.37% |
| CHEMBL4422 | O14842 | Free fatty acid receptor 1 | 80.80% | 93.33% |
| CHEMBL3902 | P09211 | Glutathione S-transferase Pi | 80.43% | 93.81% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 162814878 |
| LOTUS | LTS0212292 |
| wikiData | Q104169592 |