| Name | SMILES | Flavor type | Data resource |
|---|---|---|---|
| Aspirin | CC(=O)Oc1ccccc1C(=O)O | Bitter | BitterDB, ChemTasteDB |
| Theophylline sodium acetate | CC(=O)[O-].Cn1c(=O)c2[nH]cnc2n(C)c1=O.[Na+] | Bitter | BitterSweet, BitterDB, ChemTasteDB |
| 2-Acetylbenzofuran | CC(=O)c1cc2ccccc2o1 | Bitter | BitterSweet |
| 6982-72-5 | CC(=O)c1ccc(C)[nH]1 | Bitter | BitterSweet |
| 35250-69-2 | CC(=O)c1ccc(C)n1C | Bitter | BitterSweet |
| 2,6-Diacetylpyridine | CC(=O)c1cccc(C(C)=O)n1 | Bitter | BitterSweet |
| Acetophenone | CC(=O)c1ccccc1 | Bitter | ChemTasteDB, Off-flavor, Riechstoff-Lexikon - Index, FlavorDB, AromaDB, BitterDB, Flavornet |
| Acetylpyrazine | CC(=O)c1cnccn1 | Bitter | ChemTasteDB, Food Flavor Laboratory, FlavorDB, AromaDB, BitterDB, Flavornet, BitterSweet |
| acetylgenistin | CC(=O)c1oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c2c(=O)c1-c1ccc(O)cc1 | Bitter | Natural_TAS2R_agonists, PlantMolecularTasteDB |
| Thioacetanilide | CC(=S)Nc1ccccc1 | Bitter | BitterSweet, BitterDB, ChemTasteDB |
| 5-(1-carboxyethyl)-2-(6-hydroxy-7,7-dimethyl-1-oxo-1,3,3a,6,7,7a-hexahydro-2-benzofuran-3a-yl)cyclohexane-1-carboxylic acid | CC(C(=O)O)C1CCC(C23C=CC(O)C(C)(C)C2C(=O)OC3)C(C(=O)O)C1 | Bitter | ChemTasteDB |
| 5-(1-carboxyethyl)-2-(7,7-dimethyl-1,6-dioxo-octahydro-2-benzofuran-3a-yl)cyclohexane-1-carboxylic acid | CC(C(=O)O)C1CCC(C23CCC(=O)C(C)(C)C2C(=O)OC3)C(C(=O)O)C1 | Bitter | ChemTasteDB |
| 5-(1-carboxyethyl)-2-(6-hydroxy-7,7-dimethyl-1-oxo-octahydro-2-benzofuran-3a-yl)cyclohexane-1-carboxylic acid | CC(C(=O)O)C1CCC(C23CCC(O)C(C)(C)C2C(=O)OC3)C(C(=O)O)C1 | Bitter | ChemTasteDB |
| Cinnamedrine | CC(C(O)c1ccccc1)N(C)CC=Cc1ccccc1 | Bitter | BitterSweet, BitterDB, ChemTasteDB |
| Linamarin | CC(C)(C#N)OC1OC(CO)C(O)C(O)C1O | Bitter | ChemTasteDB, Natural_TAS2R_agonists, PlantMolecularTasteDB, BitterDB, BitterSweet |
| linamarin | CC(C)(C#N)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O | Bitter | PhytoMolecularTasteDB |
| Benzethonium chloride | CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1.[Cl-] | Bitter | BitterSweet, BitterDB, ChemTasteDB |
| Sodium N-[4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]sulfamate | CC(C)(C)OC(=O)c1ccc(NS(=O)(=O)[O-])cc1.[Na+] | Bitter | ChemTasteDB |
| Sodium N-(3-tert-butylphenyl)sulfamate | CC(C)(C)c1cccc(NS(=O)(=O)[O-])c1.[Na+] | Bitter | ChemTasteDB |
| Sodium N-(4-tert-butyl-1,3-thiazol-2-yl)sulfamate | CC(C)(C)c1csc(NS(=O)(=O)[O-])n1.[Na+] | Bitter | ChemTasteDB |
| brydioside A | CC(C)(CCC(=O)C(C)(O)C1CCC2(C)C3CC=C4C(CC(OC5OC(CO)C(O)C(O)C5O)C(=O)C4(C)C)C3(C)C(=O)CC12C)OC1OC(CO)C(O)C(O)C1O | Bitter | PlantMolecularTasteDB |
| Pantothenic acid calcium salt | CC(C)(CO)C(O)C(=O)NCCC(=O)[O-].CC(C)(CO)C(O)C(=O)NCCC(=O)[O-].[Ca+2] | Bitter | ChemTasteDB, BitterSweet, BitterDB, FlavorDB |
| Cucurbitacin F | CC(C)(O)/C=C/C(=O)[C@](C)(O)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C[C@H](O)[C@@H](O)C4(C)C)[C@]3(C)C(=O)C[C@]12C | Bitter | BitterSweet |
| oxypeucedanin hydrate | CC(C)(O)C(O)COc1c2ccoc2cc2oc(=O)ccc12 | Bitter | PlantMolecularTasteDB |
| Picrotin | CC(C)(O)C1C2OC(=O)C1C1(O)CC3OC34C(=O)OC2C14C | Bitter | Natural_TAS2R_agonists, PlantMolecularTasteDB, BitterDB, ChemTasteDB |
| obacunoic acid | CC(C)(O)C1CC(=O)C2(C)C(CCC3(C)C(c4ccoc4)OC(=O)C4OC432)C1(C)C=CC(=O)O | Bitter | PlantMolecularTasteDB |
| ichangin | CC(C)(O)C1CC(=O)C2(C)C(CCC3(C)C(c4ccoc4)OC(=O)C4OC432)C12COC(=O)CC2O | Bitter | PlantMolecularTasteDB |
| 2-{4-[(hydroxyimino)methyl]cyclohex-3-en-1-yl}propan-2-ol | CC(C)(O)C1CC=C(C=NO)CC1 | Bitter | ChemTasteDB |
| Cucurbitacin I | CC(C)(O)C=CC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(C=C(O)C(=O)C4(C)C)C3(C)C(=O)CC12C | Bitter | Natural_TAS2R_agonists, PlantMolecularTasteDB, BitterDB, ChemTasteDB |
| cucurbitacin I 2-O-glucoside | CC(C)(O)C=CC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(C=C(OC5OC(CO)C(O)C(O)C5O)C(=O)C4(C)C)C3(C)C(=O)CC12C | Bitter | PlantMolecularTasteDB |