bergenin
(YWJXCIXBAKGUKZ-HJJNZUOJSA-N)
Structure
- SMILES
- OC[C@H]1O[C@@H]2[C@@H]([C@H]([C@@H]1O)O)OC(=O)c1c2c(O)c(c(c1)O)OC
- Molecular Formula:
- C14H16O9
- Molecular Weight:
- 328.271
- Log P:
- -1.2006
- Hydrogen Bond Acceptor:
- 9
- Hydrogen Bond Donor:
- 5
- TPSA:
- 145.91
- CAS Number(s):
- 477-90-7
Synonym(s)
1.
bergenin
2.
bergenin hydrate
3.
bergenin, (2alpha,3beta,4alpha,4aalpha,10bbeta)-isomer, sodium salt
External Link(s)
| MeSH | C006741 |
| PubChem Compound | 66065 |
| BindingDB | 50349518 |
| ChEBI | 69499 |
| CHEMBL | CHEMBL273019 |
| KEGG | cpd:C09919 dr:D01040 |
| ZINC | 4046820 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Inflammation | 30365937 | CTD |
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