EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C4H5NO4 |
| Net Charge | -2 |
| Average Mass | 131.087 |
| Monoisotopic Mass | 131.02295 |
| SMILES | N[C@@H](CC(=O)[O-])C(=O)[O-] |
| InChI | InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-2/t2-/m0/s1 |
| InChIKey | CKLJMWTZIZZHCS-REOHCLBHSA-L |
| Roles Classification |
|---|
| Biological Roles: | fundamental metabolite Any metabolite produced by all living cells. fundamental metabolite Any metabolite produced by all living cells. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| L-aspartate(2−) (CHEBI:29993) has role fundamental metabolite (CHEBI:78675) |
| L-aspartate(2−) (CHEBI:29993) is a L-α-amino acid anion (CHEBI:59814) |
| L-aspartate(2−) (CHEBI:29993) is a aspartate(2−) (CHEBI:29995) |
| L-aspartate(2−) (CHEBI:29993) is conjugate base of L-aspartate(1−) (CHEBI:29991) |
| L-aspartate(2−) (CHEBI:29993) is enantiomer of D-aspartate(2−) (CHEBI:29994) |
| Incoming Relation(s) |
| (3R)-3-hydroxy-L-aspartate(2−) (CHEBI:33196) has functional parent L-aspartate(2−) (CHEBI:29993) |
| (3S)-3-hydroxy-L-aspartate(2−) (CHEBI:17838) has functional parent L-aspartate(2−) (CHEBI:29993) |
| N-acetyl-L-aspartate(2−) (CHEBI:16953) has functional parent L-aspartate(2−) (CHEBI:29993) |
| N-amidino-L-aspartate(2−) (CHEBI:32813) has functional parent L-aspartate(2−) (CHEBI:29993) |
| N-formimidoyl-L-aspartate(2−) (CHEBI:18387) has functional parent L-aspartate(2−) (CHEBI:29993) |
| N-formyl-L-aspartate(2−) (CHEBI:16923) has functional parent L-aspartate(2−) (CHEBI:29993) |
| 4-phospho-L-aspartate (CHEBI:30407) has functional parent L-aspartate(2−) (CHEBI:29993) |
| L-aspartate(1−) (CHEBI:29991) is conjugate acid of L-aspartate(2−) (CHEBI:29993) |
| D-aspartate(2−) (CHEBI:29994) is enantiomer of L-aspartate(2−) (CHEBI:29993) |
| IUPAC Names |
|---|
| (2S)-2-aminobutanedioate |
| L-aspartate |
| Synonyms | Source |
|---|---|
| (2S)-2-aminosuccinate | ChEBI |
| L-aspartate(2−) | JCBN |
| L-aspartic acid dianion | JCBN |
| Registry Numbers | Sources |
|---|---|
| Gmelin:327367 | Gmelin |
| Reaxys:4133557 | Reaxys |