EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H13NO6 |
| Net Charge | 0 |
| Average Mass | 231.204 |
| Monoisotopic Mass | 231.07429 |
| SMILES | CC(=O)N[C@@H](CCCC(=O)C(=O)O)C(=O)O |
| InChI | InChI=1S/C9H13NO6/c1-5(11)10-6(8(13)14)3-2-4-7(12)9(15)16/h6H,2-4H2,1H3,(H,10,11)(H,13,14)(H,15,16)/t6-/m0/s1 |
| InChIKey | RVHKMLVNOXVQRH-LURJTMIESA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (S)-2-acetamido-6-oxopimelic acid (CHEBI:17355) has functional parent (S)-2-amino-6-oxopimelic acid (CHEBI:28245) |
| (S)-2-acetamido-6-oxopimelic acid (CHEBI:17355) is a N-acyl-amino acid (CHEBI:51569) |
| (S)-2-acetamido-6-oxopimelic acid (CHEBI:17355) is a dicarboxylic fatty acid (CHEBI:189840) |
| (S)-2-acetamido-6-oxopimelic acid (CHEBI:17355) is a oxo dicarboxylic acid (CHEBI:36145) |
| (S)-2-acetamido-6-oxopimelic acid (CHEBI:17355) is conjugate acid of (S)-2-acetamido-6-oxopimelate(2−) (CHEBI:58117) |
| Incoming Relation(s) |
| (S)-2-acetamido-6-oxopimelate(2−) (CHEBI:58117) is conjugate base of (S)-2-acetamido-6-oxopimelic acid (CHEBI:17355) |
| IUPAC Name |
|---|
| (2S)-2-acetamido-6-oxoheptanedioic acid |
| Synonyms | Source |
|---|---|
| N-Acetyl-L-2-amino-6-oxopimelate | KEGG COMPOUND |
| L-2-Acetamido-6-oxoheptanedioate | KEGG COMPOUND |
| L-2-Acetamido-6-oxopimelate | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C05539 | KEGG COMPOUND |