Esculin
(XHCADAYNFIFUHF-TVKJYDDYSA-N)
Structure
- SMILES
- OC[C@H]1O[C@@H](Oc2cc3ccc(=O)oc3cc2O)[C@@H]([C@H]([C@@H]1O)O)O
- Type(s)
- Approved
- Molecular Formula:
- C15H16O9
- Molecular Weight:
- 340.282
- Log P:
- -1.3227
- Hydrogen Bond Acceptor:
- 9
- Hydrogen Bond Donor:
- 5
- TPSA:
- 149.82
- CAS Number(s):
- 531-75-9; 66778-17-4
Synonym(s)
1.
Esculin
2.
Aesculin
3.
Esculoside
4.
Venoplant
External Link(s)
| MeSH | D004929 |
| PubChem Compound | 5281417 |
| ChEBI | 4853 |
| CHEMBL | CHEMBL482581 |
| DrugBank | DB13155 |
| KEGG | cpd:C09264 |
| ZINC | 3860441 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Stomach Diseases | 20678495 | CTD |
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