N-(5-aminopentyl)-N-hydroxy-N'-{5-[hydroxy(4-{[5-(hydroxyimino)pentyl]amino}-4-oxobutanoyl)amino]pentyl}butanediamide
| Internal ID | 154667e5-2cb4-4319-8107-4dda6cde4137 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Carboxylic acid derivatives > Hydroxamic acids |
| IUPAC Name | N'-(5-aminopentyl)-N'-hydroxy-N-[5-[hydroxy-[4-[[(5E)-5-hydroxyiminopentyl]amino]-4-oxobutanoyl]amino]pentyl]butanediamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C23H44N6O7/c24-14-4-1-8-18-28(35)22(32)12-11-21(31)26-16-6-3-9-19-29(36)23(33)13-10-20(30)25-15-5-2-7-17-27-34/h17,34-36H,1-16,18-19,24H2,(H,25,30)(H,26,31)/b27-17+ |
| InChI Key | RPHCJSPQKSVBSH-WPWMEQJKSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C23H44N6O7 |
| Molecular Weight | 516.60 g/mol |
| Exact Mass | 516.32714776 g/mol |
| Topological Polar Surface Area (TPSA) | 198.00 Ų |
| XlogP | -1.80 |
| N-(5-aminopentyl)-N-hydroxy-N'-{5-[hydroxy(4-{[5-(hydroxyimino)pentyl]amino}-4-oxobutanoyl)amino]pentyl}butanediamide |
| abloxime / IC202C |
| CHEBI:66067 |
| LMFA08020184 |
| N'-(5-aminopentyl)-N'-hydroxy-N-[5-[hydroxy-[4-[[(5E)-5-hydroxyiminopentyl]amino]-4-oxobutanoyl]amino]pentyl]butanediamide |
![2D Structure of N-(5-aminopentyl)-N-hydroxy-N'-{5-[hydroxy(4-{[5-(hydroxyimino)pentyl]amino}-4-oxobutanoyl)amino]pentyl}butanediamide](https://plantaedb.com/storage/docs/compounds/2023/11/048eb8e0-85b5-11ee-bde3-33a77ce6b7ff.jpg "2D Structure of N-(5-aminopentyl)-N-hydroxy-N'-{5-[hydroxy(4-{[5-(hydroxyimino)pentyl]amino}-4-oxobutanoyl)amino]pentyl}butanediamide")
| 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 |
|---|---|---|---|---|
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 96.66% | 99.17% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 94.13% | 91.11% |
| CHEMBL3492 | P49721 | Proteasome Macropain subunit | 94.08% | 90.24% |
| CHEMBL2581 | P07339 | Cathepsin D | 92.91% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 91.71% | 96.09% |
| CHEMBL2107 | P61073 | C-X-C chemokine receptor type 4 | 90.76% | 93.10% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 90.75% | 97.29% |
| CHEMBL2664 | P23526 | Adenosylhomocysteinase | 90.30% | 86.67% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 89.57% | 89.34% |
| CHEMBL5701 | Q9H2K8 | Serine/threonine-protein kinase TAO3 | 88.39% | 96.67% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 87.21% | 94.33% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 87.18% | 97.21% |
| CHEMBL2292 | Q13627 | Dual-specificity tyrosine-phosphorylation regulated kinase 1A | 86.20% | 93.24% |
| CHEMBL5261 | Q7L7X3 | Serine/threonine-protein kinase TAO1 | 86.13% | 89.33% |
| CHEMBL2514 | O95665 | Neurotensin receptor 2 | 84.59% | 100.00% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 83.76% | 100.00% |
| CHEMBL1829 | O15379 | Histone deacetylase 3 | 83.74% | 95.00% |
| CHEMBL4581 | P52732 | Kinesin-like protein 1 | 82.77% | 93.18% |
| CHEMBL1974 | P36888 | Tyrosine-protein kinase receptor FLT3 | 82.33% | 91.83% |
| CHEMBL3629 | P68400 | Casein kinase II alpha | 81.20% | 98.89% |
| CHEMBL2637 | P53779 | c-Jun N-terminal kinase 3 | 80.89% | 92.75% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 9958186 |
| LOTUS | LTS0074278 |
| wikiData | Q76414874 |