Drinks
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Basic Info
| FADB-China ID | F0092 |
| Food Name | Drinks |
| Chinese Name | 饮料 |
| Picture |  |
| Food Group | 饮料 |
| Food Type | Processed food |
| Update Date | Jul 12, 2019 10:36 |
Illegal Additives
| CFAD ID | C0232 |
| Substance | Coumarins |
| Molecule | Umbelliferone |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C9H6O3 |
| InChi Key | ORHBXUUXSCNDEV-UHFFFAOYSA-N |
| Isomeric SMILES | C1=CC(=CC2=C1C=CC(=O)O2)O |
| Detection Method |
| CFAD ID | C0233 |
| Substance | Coumarins |
| Molecule | Herniarin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C10H8O3 |
| InChi Key | LIIALPBMIOVAHH-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=CC2=C(C=C1)C=CC(=O)O2 |
| Detection Method |
| CFAD ID | C0234 |
| Substance | Coumarins |
| Molecule | Skimmin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C15H16O8 |
| InChi Key | VPAOSFFTKWUGAD-TVKJYDDYSA-N |
| Isomeric SMILES | C1=CC(=CC2=C1C=CC(=O)O2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O |
| Detection Method |
| CFAD ID | C0235 |
| Substance | Coumarins |
| Molecule | Limettin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C11H10O4 |
| InChi Key | NXJCRELRQHZBQA-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=CC2=C(C=CC(=O)O2)C(=C1)OC |
| Detection Method |
| CFAD ID | C0236 |
| Substance | Coumarins |
| Molecule | Coumarrayin |
| Involved Links | Processing, Dining |
| Detection Method |
| CFAD ID | C0237 |
| Substance | Coumarins |
| Molecule | Angelicone |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C16H16O5 |
| InChi Key | JEDBBFHVVHKMKS-UHFFFAOYSA-N |
| Isomeric SMILES | CC(=CC(=O)C1=C(C=C(C2=C1OC(=O)C=C2)OC)OC)C |
| Detection Method |
| CFAD ID | C0238 |
| Substance | Coumarins |
| Molecule | Esculentin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C42H68O17 |
| InChi Key | DPMVYTYRMGJDQQ-UHFFFAOYSA-N |
| Isomeric SMILES | CC1C(C(C(C(O1)OC2C(OC(CC2OC)OC3C(OC(CC3OC)OC4CCC5(C6C(C(C7(CC(CC7(C6(CC=C5C4)O)O)(C(=O)C)O)C)O)O)C)C)C)O)OC)O |
| Detection Method |
| CFAD ID | C0239 |
| Substance | Coumarins |
| Molecule | Scopoletin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C10H8O4 |
| InChi Key | RODXRVNMMDRFIK-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=C(C=C2C(=C1)C=CC(=O)O2)O |
| Detection Method |
| CFAD ID | C0240 |
| Substance | Coumarins |
| Molecule | Scopolin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C16H18O9 |
| InChi Key | SGTCGCCQZOUMJJ-YMILTQATSA-N |
| Isomeric SMILES | COC1=C(C=C2C(=C1)C=CC(=O)O2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O |
| Detection Method |
| CFAD ID | C0242 |
| Substance | Coumarins |
| Molecule | Scoparone |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C11H10O4 |
| InChi Key | GUAFOGOEJLSQBT-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=C(C=C2C(=C1)C=CC(=O)O2)OC |
| Detection Method |
| CFAD ID | C0243 |
| Substance | Coumarins |
| Molecule | Daphnetin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C9H6O4 |
| InChi Key | ATEFPOUAMCWAQS-UHFFFAOYSA-N |
| Isomeric SMILES | C1=CC(=C(C2=C1C=CC(=O)O2)O)O |
| Detection Method |
| CFAD ID | C0244 |
| Substance | Coumarins |
| Molecule | Psoralen |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C11H6O3 |
| InChi Key | ZCCUUQDIBDJBTK-UHFFFAOYSA-N |
| Isomeric SMILES | C1=CC(=O)OC2=CC3=C(C=CO3)C=C21 |
| Detection Method |
| CFAD ID | C0245 |
| Substance | Coumarins |
| Molecule | Xanthotoxol |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C11H6O4 |
| InChi Key | JWVYQQGERKEAHW-UHFFFAOYSA-N |
| Isomeric SMILES | C1=CC(=O)OC2=C(C3=C(C=CO3)C=C21)O |
| Detection Method |
| CFAD ID | C0246 |
| Substance | Coumarins |
| Molecule | Bergapten |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C12H8O4 |
| InChi Key | BGEBZHIAGXMEMV-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=C2C=CC(=O)OC2=CC3=C1C=CO3 |
| Detection Method |
| CFAD ID | C0247 |
| Substance | Coumarins |
| Molecule | Xanthotoxin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C12H8O4 |
| InChi Key | QXKHYNVANLEOEG-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2 |
| Detection Method |
| CFAD ID | C0249 |
| Substance | Coumarins |
| Molecule | Isopimpinellin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C13H10O5 |
| InChi Key | DFMAXQKDIGCMTL-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=C2C=COC2=C(C3=C1C=CC(=O)O3)OC |
| Detection Method |
| CFAD ID | C0250 |
| Substance | Coumarins |
| Molecule | Imperatorin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C16H14O4 |
| InChi Key | OLOOJGVNMBJLLR-UHFFFAOYSA-N |
| Isomeric SMILES | CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C |
| Detection Method |
| CFAD ID | C0251 |
| Substance | Coumarins |
| Molecule | Isoimperatorin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C16H14O4 |
| InChi Key | IGWDEVSBEKYORK-UHFFFAOYSA-N |
| Isomeric SMILES | CC(=CCOC1=C2C=CC(=O)OC2=CC3=C1C=CO3)C |
| Detection Method |
| CFAD ID | C0253 |
| Substance | Coumarins |
| Molecule | Angelicin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C11H6O3 |
| InChi Key | XDROKJSWHURZGO-UHFFFAOYSA-N |
| Isomeric SMILES | C1=CC2=C(C=CO2)C3=C1C=CC(=O)O3 |
| Detection Method |
| CFAD ID | C0254 |
| Substance | Coumarins |
| Molecule | Heratonol |
| Involved Links | Processing, Dining |
| Detection Method |
| CFAD ID | C0255 |
| Substance | Coumarins |
| Molecule | Sphondin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C12H8O4 |
| InChi Key | DLCJNIBLOSKIQW-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=C2C(=C3C(=C1)C=CC(=O)O3)C=CO2 |
| Detection Method |
| CFAD ID | C0256 |
| Substance | Coumarins |
| Molecule | Isobergapten |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C12H8O4 |
| InChi Key | AJSPSRWWZBBIOR-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=C2C=CC(=O)OC2=C3C=COC3=C1 |
| Detection Method |
| CFAD ID | C0257 |
| Substance | Coumarins |
| Molecule | Pimpinellin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C13H10O5 |
| InChi Key | BQPRWZCEKZLBHL-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=C(C2=C(C=CO2)C3=C1C=CC(=O)O3)OC |
| Detection Method |
| CFAD ID | C0258 |
| Substance | Coumarins |
| Molecule | Xanthyetin |
| Involved Links | Processing, Dining |
| Detection Method |
| CFAD ID | C0259 |
| Substance | Coumarins |
| Molecule | Xanthoxyletin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C15H14O4 |
| InChi Key | JSJIIHRNDMLJGK-UHFFFAOYSA-N |
| Isomeric SMILES | CC1(C=CC2=C(O1)C=C3C(=C2OC)C=CC(=O)O3)C |
| Detection Method |
| CFAD ID | C0260 |
| Substance | Coumarins |
| Molecule | Luvangetin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C15H14O4 |
| InChi Key | XYPWCJWXFYYGPA-UHFFFAOYSA-N |
| Isomeric SMILES | CC1(C=CC2=C(O1)C(=C3C(=C2)C=CC(=O)O3)OC)C |
| Detection Method |
| CFAD ID | C0261 |
| Substance | Coumarins |
| Molecule | Poncitrin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C20H22O4 |
| InChi Key | QBFYQVZGIDUNIY-UHFFFAOYSA-N |
| Isomeric SMILES | CC1(C=CC2=C(C3=C(C(=C2O1)C(C)(C)C=C)OC(=O)C=C3)OC)C |
| Detection Method |
| CFAD ID | C0262 |
| Substance | Coumarins |
| Molecule | Seselin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C14H12O3 |
| InChi Key | QUVCQYQEIOLHFZ-UHFFFAOYSA-N |
| Isomeric SMILES | CC1(C=CC2=C(O1)C=CC3=C2OC(=O)C=C3)C |
| Detection Method |
| CFAD ID | C0263 |
| Substance | Coumarins |
| Molecule | 5-hydroxyseselin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C24H33N3O |
| InChi Key | RZZOFHVPWHZYRI-UHFFFAOYSA-N |
| Isomeric SMILES | CC1=CC(=CC=C1)CN2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4OC |
| Detection Method |
| CFAD ID | C0264 |
| Substance | Coumarins |
| Molecule | Norbraylin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C14H12O4 |
| InChi Key | OYPWMLRFDXSKJG-UHFFFAOYSA-N |
| Isomeric SMILES | CC1(C=CC2=C3C(=CC(=C2O1)O)C=CC(=O)O3)C |
| Detection Method |
| CFAD ID | C0265 |
| Substance | Coumarins |
| Molecule | 5-methoxyseselin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C15H14O4 |
| InChi Key | ZNMRQYJUVCXNGK-UHFFFAOYSA-N |
| Isomeric SMILES | CC1(C=CC2=C3C(=C(C=C2O1)OC)C=CC(=O)O3)C |
| Detection Method |
| CFAD ID | C0266 |
| Substance | Coumarins |
| Molecule | Braylin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C15H14O4 |
| InChi Key | UOFNVZWWIXXTMZ-UHFFFAOYSA-N |
| Isomeric SMILES | CC1(C=CC2=C3C(=CC(=C2O1)OC)C=CC(=O)O3)C |
| Detection Method |
| CFAD ID | C0267 |
| Substance | Coumarins |
| Molecule | Isoglycycoumarin |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C21H20O6 |
| InChi Key | PHHAXWBLJNBVNS-UHFFFAOYSA-N |
| Isomeric SMILES | CC1(CCC2=C(O1)C=C3C(=C2OC)C=C(C(=O)O3)C4=C(C=C(C=C4)O)O)C |
| Detection Method |
| CFAD ID | C0268 |
| Substance | Coumarins |
| Molecule | Inflacoumarin A |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C20H18O4 |
| InChi Key | RNBLSJGPSGNSIN-UHFFFAOYSA-N |
| Isomeric SMILES | CC(=CCC1=CC2=C(C=C1O)OC(=O)C=C2C3=CC=C(C=C3)O)C |
| Detection Method |
| CFAD ID | C0269 |
| Substance | Coumarins |
| Molecule | Wedelolactone |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C16H10O7 |
| InChi Key | XQDCKJKKMFWXGB-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=CC(=C2C(=C1)OC(=O)C3=C2OC4=CC(=C(C=C43)O)O)O |
| Detection Method |
| CFAD ID | C0270 |
| Substance | Coumarins |
| Molecule | Wedelolactone |
| Involved Links | Processing, Dining |
| Structure | |
| Purpose of Addition | Improve flavor |
| Formula | C16H10O7 |
| InChi Key | XQDCKJKKMFWXGB-UHFFFAOYSA-N |
| Isomeric SMILES | COC1=CC(=C2C(=C1)OC(=O)C3=C2OC4=CC(=C(C=C43)O)O)O |
| Detection Method |
| CFAD ID | C0271 |
| Substance | Coumarins |
| Molecule | Isodemethywedelolactone |
| Involved Links | Processing, Dining |
| Detection Method |
| CFAD ID | C0272 |
| Substance | Coumarins |
| Molecule | Demethywedelolactone |
| Involved Links | Processing, Dining |
| Detection Method |
Predicted Illegal Additives
| ID | P1898 |
| Name | Aesculetin |
| Structure | |
| Source | ToxinDB |
| Basis of prediction | Umbelliferone |
| PubChem Link | Link |
| ID | P1896 |
| Name | 7-ETHOXYCOUMARIN |
| Structure | |
| Source | ToxinDB |
| Basis of prediction | Umbelliferone |
| PubChem Link | Link |
| ID | P1897 |
| Name | Esculetin |
| Structure | |
| Source | ToxinDB |
| Basis of prediction | Umbelliferone |
| PubChem Link | Link |
| ID | P1899 |
| Name | 7-hydroxy-4-methyl-2H-chromen-2-one |
| Structure | |
| Source | DrugBank, ToxCast & Tox21 Chemicals |
| Basis of prediction | Umbelliferone |
| PubChem Link | Link |
| ID | P1900 |
| Name | Scopoletin |
| Structure | |
| Source | FRCD |
| Basis of prediction | Umbelliferone |
| PubChem Link | Link |
| ID | P1901 |
| Name | 4-Methylumbelliferone |
| Structure | |
| Source | DrugBank, ToxCast & Tox21 Chemicals |
| Basis of prediction | Umbelliferone |
| PubChem Link | Link |
| ID | P1902 |
| Name | 3-Chloro-7-hydroxy-4-methyl-2-benzopyrone |
| Structure | |
| Source | ToxCast & Tox21 Chemicals |
| Basis of prediction | Umbelliferone |
| PubChem Link | Link |
| ID | P1903 |
| Name | 5,7-Dihydroxy-4-methylcoumarin |
| Structure | |
| Source | ToxCast & Tox21 Chemicals |
| Basis of prediction | Umbelliferone |
| PubChem Link | Link |
| ID | P1904 |
| Name | Daphnetin |
| Structure | |
| Source | FRCD |
| Basis of prediction | Umbelliferone |
| PubChem Link | Link |
| ID | P1935 |
| Name | 7-Hydroxycoumarin |
| Structure | |
| Source | FRCD |
| Basis of prediction | Herniarin |
| PubChem Link | Link |
| ID | P1936 |
| Name | Umbelliferone |
| Structure | |
| Source | FRCD |
| Basis of prediction | Herniarin |
| PubChem Link | Link |
| ID | P1937 |
| Name | Scoparone |
| Structure | |
| Source | ToxinDB |
| Basis of prediction | Herniarin |
| PubChem Link | Link |
| ID | P1938 |
| Name | 5,7-Dimethoxy-2H-chromen-2-one |
| Structure | |
| Source | ToxCast & Tox21 Chemicals |
| Basis of prediction | Herniarin |
| PubChem Link | Link |
| ID | P1939 |
| Name | 4-Methylumbelliferyl-Alpha-D-Glucose |
| Structure | |
| Source | DrugBank |
| Basis of prediction | Skimmin |
| PubChem Link | Link |
| ID | P1940 |
| Name | 4-Methylumbelliferyl ß-D-Glucuronide (MUG) |
| Structure | |
| Source | FRCD |
| Basis of prediction | Skimmin |
| PubChem Link | Link |
| ID | P1941 |
| Name | Esculin |
| Structure | |
| Source | FRCD |
| Basis of prediction | Scopolin |
| PubChem Link | Link |
| ID | P1942 |
| Name | Angelicin |
| Structure | |
| Source | ToxinDB, T3DB, IARC Carcinogens Group 3 |
| Basis of prediction | Psoralen |
| PubChem Link | Link |
| ID | P1943 |
| Name | Methoxsalen |
| Structure | |
| Source | ToxCast & Tox21 Chemicals, T3DB, DrugBank, HPV EPA Chemicals, ToxinDB, IARC Carcinogens Group 1, OECD HPV Chemicals |
| Basis of prediction | Psoralen |
| PubChem Link | Link |
| ID | P1944 |
| Name | Bergapten |
| Structure | |
| Source | ToxinDB |
| Basis of prediction | Psoralen |
| PubChem Link | Link |
| ID | P1945 |
| Name | Isobergapten |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Psoralen |
| PubChem Link | Link |
| ID | P1946 |
| Name | Sphondin |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Psoralen |
| PubChem Link | Link |
| ID | P1947 |
| Name | 4,5'-Dimethylangelicin plus ultraviolet A radiation |
| Structure | |
| Source | IARC Carcinogens Group 3 |
| Basis of prediction | Psoralen |
| PubChem Link | Link |
| ID | P1948 |
| Name | 4,4'-Dimethylangelicin plus ultraviolet A radiation |
| Structure | |
| Source | IARC Carcinogens Group 3 |
| Basis of prediction | Psoralen |
| PubChem Link | Link |
| ID | P1949 |
| Name | 5-Methylangelicin plus ultraviolet A radiation |
| Structure | |
| Source | IARC Carcinogens Group 3 |
| Basis of prediction | Psoralen |
| PubChem Link | Link |
| ID | P1950 |
| Name | 9-Hydroxy-4-Methoxypsoralen |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Xanthotoxol |
| PubChem Link | Link |
| ID | P1951 |
| Name | Psoralen |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Xanthotoxol |
| PubChem Link | Link |
| ID | P1952 |
| Name | 9-Hydroxy-4-methoxypsoralen |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Xanthotoxol |
| PubChem Link | Link |
| ID | P1953 |
| Name | Isoimperatorin |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Bergapten |
| PubChem Link | Link |
| ID | P1954 |
| Name | Isopimpinellin |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Bergapten |
| PubChem Link | Link |
| ID | P1955 |
| Name | Pimpinellin |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Bergapten |
| PubChem Link | Link |
| ID | P1956 |
| Name | Imperatorin |
| Structure | |
| Source | ToxinDB, T3DB, ToxCast & Tox21 Chemicals |
| Basis of prediction | Xanthotoxin |
| PubChem Link | Link |
| ID | P1957 |
| Name | Phellopterin |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Isopimpinellin |
| PubChem Link | Link |
| ID | P1958 |
| Name | Khellin |
| Structure | |
| Source | ToxCast & Tox21 Chemicals |
| Basis of prediction | Isopimpinellin |
| PubChem Link | Link |
| ID | P1959 |
| Name | Heratomin |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Imperatorin |
| PubChem Link | Link |
| ID | P0082 |
| Name | Bergamottin |
| Structure | |
| Source | ToxinDB, T3DB |
| Basis of prediction | Isoimperatorin |
| PubChem Link | Link |
| ID | P1964 |
| Name | COUMESTROL |
| Structure | |
| Source | ToxinDB, ToxCast & Tox21 Chemicals |
| Basis of prediction | Wedelolactone |
| PubChem Link | Link |
| ID | P1965 |
| Name | Coumestrol |
| Structure | |
| Source | ToxinDB, ToxCast & Tox21 Chemicals |
| Basis of prediction | Wedelolactone |
| PubChem Link | Link |