cyclo[DL-Leu-DL-OLeu-DL-Val-DL-N(Me)Leu-DL-OVal-DL-Val]
| Internal ID | def89c65-c4bc-4303-81bf-d9c8d864e6a3 |
| Taxonomy | Organic acids and derivatives > Peptidomimetics > Depsipeptides > Cyclic depsipeptides |
| IUPAC Name | 4-methyl-3,9,12-tris(2-methylpropyl)-6,15,18-tri(propan-2-yl)-1,10-dioxa-4,7,13,16-tetrazacyclooctadecane-2,5,8,11,14,17-hexone |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C34H60N4O8/c1-17(2)14-23-33(43)45-25(16-19(5)6)29(39)37-27(21(9)10)32(42)38(13)24(15-18(3)4)34(44)46-28(22(11)12)31(41)36-26(20(7)8)30(40)35-23/h17-28H,14-16H2,1-13H3,(H,35,40)(H,36,41)(H,37,39) |
| InChI Key | IJWAUKTXQSBJRZ-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C34H60N4O8 |
| Molecular Weight | 652.90 g/mol |
| Exact Mass | 652.44111488 g/mol |
| Topological Polar Surface Area (TPSA) | 160.00 Ų |
| XlogP | 6.70 |
| There are no found synonyms. |
![2D Structure of cyclo[DL-Leu-DL-OLeu-DL-Val-DL-N(Me)Leu-DL-OVal-DL-Val]](https://plantaedb.com/storage/docs/compounds/2023/11/cyclodl-leu-dl-oleu-dl-val-dl-nmeleu-dl-oval-dl-val.jpg "2D Structure of cyclo[DL-Leu-DL-OLeu-DL-Val-DL-N(Me)Leu-DL-OVal-DL-Val]")
| 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 | 96.05% | 98.95% |
| CHEMBL1949 | P62937 | Cyclophilin A | 95.79% | 98.57% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.18% | 96.09% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 95.01% | 97.25% |
| CHEMBL3837 | P07711 | Cathepsin L | 94.02% | 96.61% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 93.99% | 90.08% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 92.29% | 85.14% |
| CHEMBL4072 | P07858 | Cathepsin B | 90.02% | 93.67% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 89.40% | 98.59% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 88.45% | 95.56% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 88.38% | 88.56% |
| CHEMBL333 | P08253 | Matrix metalloproteinase-2 | 87.29% | 96.31% |
| CHEMBL2563 | Q9UQL6 | Histone deacetylase 5 | 86.56% | 89.67% |
| CHEMBL4588 | P22894 | Matrix metalloproteinase 8 | 84.76% | 94.66% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 83.97% | 94.75% |
| CHEMBL321 | P14780 | Matrix metalloproteinase 9 | 82.89% | 92.12% |
| CHEMBL332 | P03956 | Matrix metalloproteinase-1 | 81.38% | 94.50% |
| CHEMBL3392948 | Q9NP59 | Solute carrier family 40 member 1 | 80.40% | 95.00% |
| CHEMBL2413 | P32246 | C-C chemokine receptor type 1 | 80.34% | 89.50% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 12442969 |
| LOTUS | LTS0067330 |
| wikiData | Q105114174 |