EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H12O4S2 |
| Net Charge | 0 |
| Average Mass | 212.292 |
| Monoisotopic Mass | 212.01770 |
| SMILES | [H]OC([H])([H])[C@@]1([H])O[C@@]([H])(S[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])S[H] |
| InChI | InChI=1S/C6H12O4S2/c7-1-2-5(11)3(8)4(9)6(12)10-2/h2-9,11-12H,1H2/t2-,3-,4-,5-,6+/m1/s1 |
| InChIKey | MUOMBPNNVXJUGT-UKFBFLRUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE (CHEBI:45849) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE | PDBeChem |
| 1,4-dithio-beta-D-glucopyranose | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| SSG | PDBeChem |