EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C5H8O5 |
| Net Charge | 0 |
| Average Mass | 148.114 |
| Monoisotopic Mass | 148.03717 |
| SMILES | C[C@@](O)(CC(=O)O)C(=O)O |
| InChI | InChI=1S/C5H8O5/c1-5(10,4(8)9)2-3(6)7/h10H,2H2,1H3,(H,6,7)(H,8,9)/t5-/m1/s1 |
| InChIKey | XFTRTWQBIOMVPK-RXMQYKEDSA-N |
| Roles Classification |
|---|
| Chemical Roles: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Roles: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). algal metabolite Any eukaryotic metabolite produced during a metabolic reaction in algae including unicellular organisms like chlorella and diatoms to multicellular organisms like giant kelps and brown algae. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| D-citramalic acid (CHEBI:15586) is a citramalic acid (CHEBI:15584) |
| D-citramalic acid (CHEBI:15586) is conjugate acid of D-citramalate(2−) (CHEBI:30934) |
| Incoming Relation(s) |
| (3R)-citramalyl-CoA (CHEBI:75860) has functional parent D-citramalic acid (CHEBI:15586) |
| D-citramalate(2−) (CHEBI:30934) is conjugate base of D-citramalic acid (CHEBI:15586) |
| IUPAC Name |
|---|
| (2R)-2-hydroxy-2-methylbutanedioic acid |
| Synonyms | Source |
|---|---|
| (R)-2-Methylmalic acid | KEGG COMPOUND |
| (3R)-Citramalic acid | KEGG COMPOUND |
| (3R)-alpha-Hydroxypyrotartaric acid | KEGG COMPOUND |
| D-Citramalic acid | KEGG COMPOUND |
| D-alpha-Hydroxypyrotartaric acid | KEGG COMPOUND |
| (2R)-2-hydroxy-2-methylsuccinic acid | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| C02612 | KEGG COMPOUND |