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CHEBI:749278 - caffeine citrate
| Formula | C6H8O7.C8H10N4O2 |
| Net Charge | 0 |
| Average Mass | 386.317 |
| Monoisotopic Mass | 386.10738 |
| SMILES | Cn1c(=O)c2c(ncn2C)n(C)c1=O.O=C(O)CC(O)(CC(=O)O)C(=O)O |
| InChI | InChI=1S/C8H10N4O2.C6H8O7/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;7-3(8)1-6(13,5(11)12)2-4(9)10/h4H,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12) |
| InChIKey | RCQXSQPPHJPGOF-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Biological Role: | analgesic An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms. |
| Applications: | analgesic An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms. gastrointestinal drug A drug used for its effects on the gastrointestinal system, e.g. controlling gastric acidity, regulating gastrointestinal motility and water flow, and improving digestion. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| caffeine citrate (CHEBI:749278) has role analgesic (CHEBI:35480) |
| caffeine citrate (CHEBI:749278) has role gastrointestinal drug (CHEBI:55324) |
| caffeine citrate (CHEBI:749278) is a oxopurine (CHEBI:25810) |
| Synonyms | Source |
|---|---|
| Caffeine mixture with citric acid | ChEMBL |
| Citrated caffeine | ChEMBL |
| Brand Names | Source |
|---|---|
| Cafcit | ChEMBL |
| Gencebok | ChEMBL |
| Peyona (previously nymusa) | ChEMBL |
| Citations |
|---|