EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C5H8O6 |
| Net Charge | 0 |
| Average Mass | 164.113 |
| Monoisotopic Mass | 164.03209 |
| SMILES | O=C(O)C(=O)[C@@H](O)[C@H](O)CO |
| InChI | InChI=1S/C5H8O6/c6-1-2(7)3(8)4(9)5(10)11/h2-3,6-8H,1H2,(H,10,11)/t2-,3+/m1/s1 |
| InChIKey | NKOHBIIOWAKHMF-GBXIJSLDSA-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) |
| D-xylulosonic acid (CHEBI:140287) is a oxo carboxylic acid (CHEBI:25754) |
| D-xylulosonic acid (CHEBI:140287) is conjugate acid of 2-dehydro-D-xylonate (CHEBI:28326) |
| Incoming Relation(s) |
| 2-dehydro-D-xylonate (CHEBI:28326) is conjugate base of D-xylulosonic acid (CHEBI:140287) |
| Manual Xrefs | Databases |
|---|---|
| 388894 | ChemSpider |