butein
(AYMYWHCQALZEGT-ORCRQEGFSA-N)
Structure
- SMILES
- Oc1ccc(c(c1)O)C(=O)/C=C/c1ccc(c(c1)O)O
- Molecular Formula:
- C15H12O5
- Molecular Weight:
- 272.253
- Log P:
- 2.4051
- Hydrogen Bond Acceptor:
- 5
- Hydrogen Bond Donor:
- 4
- TPSA:
- 97.99
- CAS Number(s):
- 487-52-5; 21849-70-7
Synonym(s)
1.
butein
2.
2',3,4,4'-tetrahydroxychalcone
3.
2',4',3,4-tetrahydroxychalcone
External Link(s)
| MeSH | C040918 |
| PubChem Compound | 5281222 |
| BindingDB | 50042949 |
| ChEBI | 3237 92312 |
| CHEMBL | CHEMBL128000 |
| KEGG | cpd:C08578 |
| Therapeutic Target Database | D0EW3L |
| ZINC | 12428433 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Dental Pulp Necrosis | 23318726 | CTD |
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