3-methylquercetin
(IZQSVPBOUDKVDZ-UHFFFAOYSA-N)
Structure
- SMILES
- COc1cc(ccc1O)c1oc2cc(O)cc(c2c(=O)c1O)O
- Molecular Formula:
- C16H12O7
- Molecular Weight:
- 316.262
- Log P:
- 2.2910
- Hydrogen Bond Acceptor:
- 7
- Hydrogen Bond Donor:
- 4
- TPSA:
- 120.36
- CAS Number(s):
- 480-19-3
Synonym(s)
1.
3-methylquercetin
2.
3,4',5,7-tetrahydroxy-3'-methoxy-flavone
3.
3,4',5,7-tetrahydroxy-3'-methoxyflavone
4.
3-O-methylquercetin
5.
3-methyl-quercetin
6.
iso-rhamnetin
7.
isorhamnetin
8.
isorhamnetine
External Link(s)
| MeSH | C047368 |
| PubChem Compound | 5281654 |
| BindingDB | 23409 |
| ChEBI | 6052 |
| CHEMBL | CHEMBL379064 |
| KEGG | cpd:C10084 |
| Therapeutic Target Database | D07YDN |
| ZINC | 517261 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Chemical and Drug Induced Liver Injury | 27151496 | CTD | |
| 2 | Inflammation | 23774260 | CTD | |
| 3 | Liver Cirrhosis | 27151496 | CTD |
Powered by :
Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120262
Copyright © 2019-2020 Laboratory of Molecular Modeling and Design, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology. All rights reserved.