esculetin
(ILEDWLMCKZNDJK-UHFFFAOYSA-N)
Structure
- SMILES
- O=c1ccc2c(o1)cc(c(c2)O)O
- Molecular Formula:
- C9H6O4
- Molecular Weight:
- 178.142
- Log P:
- 1.2042
- Hydrogen Bond Acceptor:
- 4
- Hydrogen Bond Donor:
- 2
- TPSA:
- 70.67
- CAS Number(s):
- 305-01-1; 91753-33-2
Synonym(s)
1.
esculetin
2.
6,7-dihydroxycoumarin
3.
aesculetin
External Link(s)
| MeSH | C007628 |
| PubChem Compound | 5281416 |
| BindingDB | 34571 |
| ChEBI | 490095 |
| CHEMBL | CHEMBL244743 |
| IUPHAR/BPS Guide to PHARMACOLOGY | 5180 |
| KEGG | cpd:C09263 |
| Therapeutic Target Database | D0YZ5G |
| ZINC | 57908 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Diarrhea | 20380826 | CTD | |
| 2 | Dyslipidemias | 28946194 | CTD | |
| 3 | Fatty Liver | 27769711 | CTD | |
| 4 | Hepatomegaly | 27769711 | CTD | |
| 5 | Hyperglycemia | 28946194 | CTD | |
| 6 | Hyperinsulinism | 28946194 | CTD | |
| 7 | Kidney Diseases | 21450970 | CTD | |
| 8 | Ventricular Fibrillation | 1632298 | CTD | |
| 9 | Weight Gain | 28946194 | CTD |
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