EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C13H21O6 |
| Net Charge | -1 |
| Average Mass | 273.305 |
| Monoisotopic Mass | 273.13436 |
| SMILES | C[C@H](CC/C=C/C(=O)[O-])O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O |
| InChI | InChI=1S/C13H22O6/c1-8(5-3-4-6-12(16)17)18-13-11(15)7-10(14)9(2)19-13/h4,6,8-11,13-15H,3,5,7H2,1-2H3,(H,16,17)/p-1/b6-4+/t8-,9+,10-,11-,13-/m1/s1 |
| InChIKey | GGHOMCWJOMBZEK-LHYQPRBASA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| ascr#7(1-) (CHEBI:139710) is a organic molecular entity (CHEBI:50860) |
| ascr#7(1-) (CHEBI:139710) is conjugate base of ascr#7 (CHEBI:78830) |
| Incoming Relation(s) |
| ascr#7 (CHEBI:78830) is conjugate acid of ascr#7(1-) (CHEBI:139710) |