Butanoic acid, 4-(acetylamino)-2-amino-
| Internal ID | c10c65cb-c509-40a9-a3d7-13f11f7ca289 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Alpha amino acids |
| IUPAC Name | 4-acetamido-2-aminobutanoic acid |
| SMILES (Canonical) | CC(=O)NCCC(C(=O)O)N |
| SMILES (Isomeric) | CC(=O)NCCC(C(=O)O)N |
| InChI | InChI=1S/C6H12N2O3/c1-4(9)8-3-2-5(7)6(10)11/h5H,2-3,7H2,1H3,(H,8,9)(H,10,11) |
| InChI Key | YLZRFVZUZIJABA-UHFFFAOYSA-N |
| Popularity | 3 references in papers |
| Molecular Formula | C6H12N2O3 |
| Molecular Weight | 160.17 g/mol |
| Exact Mass | 160.08479225 g/mol |
| Topological Polar Surface Area (TPSA) | 92.40 Ų |
| XlogP | -4.40 |
| 4-acetamido-2-aminobutanoic acid |
| 14531-48-7 |
| SCHEMBL1512848 |
| DTXSID10274290 |
| 2-amino-4-acetylaminobutyric acid |
| CHEBI:188981 |
| BAA19046 |
| 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 |
|---|---|---|---|---|
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.83% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 91.60% | 98.95% |
| CHEMBL3976 | Q9UHL4 | Dipeptidyl peptidase II | 91.33% | 92.29% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 89.07% | 99.17% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 84.77% | 94.33% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 83.90% | 96.95% |
| CHEMBL3437 | Q16853 | Amine oxidase, copper containing | 83.51% | 94.00% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 82.96% | 83.82% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 82.34% | 97.21% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 82.27% | 97.29% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 80.86% | 100.00% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 80.60% | 91.11% |
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.
| Acaciella angustissima |
| PubChem | 902 |
| LOTUS | LTS0173857 |
| wikiData | Q82003664 |