EMBL-EBI | Chemical Biology | ChEBI
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| Formula | H2O.C12H14O35S8.K.K.K.K.K.K.K.K.H2O.H2O.H2O.H2O.H2O.H2O |
| Net Charge | 0 |
| Average Mass | 1413.634 |
| Monoisotopic Mass | 1411.49174 |
| SMILES | O.O.O.O.O.O.O.O=S(=O)([O-])OC[C@H]1O[C@@](COS(=O)(=O)[O-])(O[C@H]2O[C@H](COS(=O)(=O)[O-])[C@@H](OS(=O)(=O)[O-])[C@H](OS(=O)(=O)[O-])[C@H]2OS(=O)(=O)[O-])[C@@H](OS(=O)(=O)[O-])[C@@H]1OS(=O)(=O)[O-].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+] |
| InChI | InChI=1S/C12H22O35S8.8K.7H2O/c13-48(14,15)37-1-4-6(43-51(22,23)24)8(45-53(28,29)30)9(46-54(31,32)33)11(40-4)42-12(3-39-50(19,20)21)10(47-55(34,35)36)7(44-52(25,26)27)5(41-12)2-38-49(16,17)18;;;;;;;;;;;;;;;/h4-11H,1-3H2,(H,13,14,15)(H,16,17,18)(H,19,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36);;;;;;;;;7*1H2/q;8*+1;;;;;;;/p-8/t4-,5-,6-,7-,8+,9-,10+,11-,12+;;;;;;;;;;;;;;;/m1.............../s1 |
| InChIKey | ZLYYTLMQNBUBHA-NGOJJLSFSA-F |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| sucrosofate potassium (CHEBI:756128) is a ketal (CHEBI:59777) |
| Synonyms | Source |
|---|---|
| AGENT M-01 | ChEMBL |
| AGENT-M-01 | ChEMBL |
| AGENTM-01 | ChEMBL |
| Sucrosofate potassium | ChEMBL |