EMBL-EBI | Chemical Biology | ChEBI
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| Formula | 2C4H7O5.Ca |
| Net Charge | 0 |
| Average Mass | 310.268 |
| Monoisotopic Mass | 310.02129 |
| SMILES | O=C([O-])[C@H](O)[C@@H](O)CO.O=C([O-])[C@H](O)[C@@H](O)CO.[Ca+2] |
| InChI | InChI=1S/2C4H8O5.Ca/c2*5-1-2(6)3(7)4(8)9;/h2*2-3,5-7H,1H2,(H,8,9);/q;;+2/p-2/t2*2-,3+;/m00./s1 |
| InChIKey | ZJXGOFZGZFVRHK-BALCVSAKSA-L |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | urine (BTO:0001419) | MetaboLights (MTBLS8662) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| L-Threonic acid Calcium Salt (CHEBI:228796) is a L-α-D-Hepp-(1→7)-L-α-D-Hepp-(1→3)-L-α-D-Hepp-(1→5)-α-Kdo (CHEBI:78618) |
| IUPAC Name |
|---|
| calcium;(2R,3S)-2,3,4-trihydroxybutanoate |