5-(Acetamidomethyl)-2-amino-5,6-dihydroxyhexanoic acid
| Internal ID | 7a34374c-462c-4520-9474-c42d6522292e |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Alpha amino acids |
| IUPAC Name | 5-(acetamidomethyl)-2-amino-5,6-dihydroxyhexanoic acid |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C9H18N2O5/c1-6(13)11-4-9(16,5-12)3-2-7(10)8(14)15/h7,12,16H,2-5,10H2,1H3,(H,11,13)(H,14,15) |
| InChI Key | YSIYXKLKKBSLKF-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C9H18N2O5 |
| Molecular Weight | 234.25 g/mol |
| Exact Mass | 234.12157168 g/mol |
| Topological Polar Surface Area (TPSA) | 133.00 Ų |
| XlogP | -4.80 |
| 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 |
|---|---|---|---|---|
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 99.84% | 83.82% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.21% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 92.25% | 98.95% |
| CHEMBL3976 | Q9UHL4 | Dipeptidyl peptidase II | 91.32% | 92.29% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 90.58% | 97.29% |
| CHEMBL236 | P41143 | Delta opioid receptor | 88.61% | 99.35% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 87.77% | 99.17% |
| CHEMBL3437 | Q16853 | Amine oxidase, copper containing | 85.73% | 94.00% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 84.59% | 100.00% |
| CHEMBL233 | P35372 | Mu opioid receptor | 83.40% | 97.93% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 82.29% | 96.95% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 80.85% | 94.33% |
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.
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| There are no matching plants. |
| PubChem | 14806460 |
| LOTUS | LTS0079951 |
| wikiData | Q105359737 |