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CHEBI:756872 - trimebutine 3-thiocarbamoylbenzenesulfonate
| Formula | C7H7NO3S2.C22H29NO5 |
| Net Charge | 0 |
| Average Mass | 604.747 |
| Monoisotopic Mass | 604.19131 |
| SMILES | CCC(COC(=O)c1cc(OC)c(OC)c(OC)c1)(c1ccccc1)N(C)C.NC(=S)c1cccc(S(=O)(=O)O)c1 |
| InChI | InChI=1S/C22H29NO5.C7H7NO3S2/c1-7-22(23(2)3,17-11-9-8-10-12-17)15-28-21(24)16-13-18(25-4)20(27-6)19(14-16)26-5;8-7(12)5-2-1-3-6(4-5)13(9,10)11/h8-14H,7,15H2,1-6H3;1-4H,(H2,8,12)(H,9,10,11) |
| InChIKey | ACKBGPXURGPUEW-UHFFFAOYSA-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) |
| trimebutine 3-thiocarbamoylbenzenesulfonate (CHEBI:756872) is a methoxybenzoic acid (CHEBI:25238) |
| Synonyms | Source |
|---|---|
| Gic-1001 | ChEMBL |
| GIC 1001 | ChEMBL |
| Trimebutine 3-thiocarbamoylbenzenesulfonate | ChEMBL |