chrysophanic acid
(LQGUBLBATBMXHT-UHFFFAOYSA-N)
Structure
- SMILES
- Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)ccc1
- Molecular Formula:
- C15H10O4
- Molecular Weight:
- 254.238
- Log P:
- 2.1816
- Hydrogen Bond Acceptor:
- 4
- Hydrogen Bond Donor:
- 2
- TPSA:
- 74.6
- CAS Number(s):
- 481-74-3
Synonym(s)
1.
chrysophanic acid
2.
2-methyl-4,5-dihydroxyanthraquinone
3.
3-methyl-1,8-dihydroxyanthraquinone
4.
chrysophanic acid, ion (1-)
5.
chrysophanol
External Link(s)
| MeSH | C027113 |
| PubChem Compound | 10208 |
| BindingDB | 50455992 |
| ChEBI | 3687 |
| CHEMBL | CHEMBL41092 |
| KEGG | cpd:C10315 |
| ZINC | 3861630 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Chemical and Drug Induced Liver Injury | 28161596 | CTD |
Powered by :
Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120263
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.