deguelin
(ORDAZKGHSNRHTD-UXHICEINSA-N)
Structure
- SMILES
- COc1cc2c(cc1OC)OC[C@@H]1[C@H]2C(=O)c2c(O1)c1C=CC(Oc1cc2)(C)C
- Molecular Formula:
- C23H22O6
- Molecular Weight:
- 394.417
- Log P:
- 4.0079
- Hydrogen Bond Acceptor:
- 6
- Hydrogen Bond Donor:
- 0
- TPSA:
- 63.22
- CAS Number(s):
- 522-17-8
Synonym(s)
1.
deguelin
2.
13,13a-dihydro-9,10-dimethoxy-3,3-dimethyl-3H-bis(1)benzopyrano(3,4-b:6',5'-e)pyran-7(7aH)-one
External Link(s)
| MeSH | C107676 |
| PubChem Compound | 107935 |
| ChEBI | 4357 |
| CHEMBL | CHEMBL393417 |
| KEGG | cpd:C10417 |
| ZINC | 3978987 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Hyperplasia | 28529457 | CTD | |
| 2 | Hypersensitivity | 28529457 | CTD | |
| 3 | Lung Neoplasms | 16288123 19336726 | CTD | |
| 4 | Lymphatic Metastasis | 20162567 | CTD | |
| 5 | Neoplasm Invasiveness | CTD | ||
| 6 | Neoplasm Metastasis | 21472727 22986522 28509438 | CTD | |
| 7 | Neoplasms, Experimental | 20162567 | CTD | |
| 8 | Neoplasms | 17764071 22623043 | CTD | |
| 9 | Poisoning | 9282833 | CTD | |
| 10 | Prostatic Neoplasms | 21472727 | CTD | |
| 11 | Skin Neoplasms | 16041863 | CTD |
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