amarogentin
SMILES | C=C[C@@H]1[C@@H]2CCOC(=O)C2=CO[C@H]1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)OC(=O)C4=C(C=C(C=C4O)O)C5=CC(=CC=C5)O |
InChIKey | DBOVHQOUSDWAPQ-WTONXPSSSA-N |
Chemical properties
Hydrogen bond acceptors | 13 |
Hydrogen bond donors | 6 |
Rotatable bonds | 7 |
Molecular weight (Da) | 586.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
TAS2R30 | T2R30 | Human | Taste 2 | T2 | pEC50 | 6.39 | 6.39 | 6.39 | Guide to Pharmacology |
TAS2R43 | T2R43 | Human | Taste 2 | T2 | pEC50 | 4.12 | 4.12 | 4.12 | Guide to Pharmacology |
TAS2R46 | T2R46 | Human | Taste 2 | T2 | pEC50 | 4.17 | 4.17 | 4.17 | Guide to Pharmacology |