picroside II
(AKNILCMFRRDTEY-NUGKWEEESA-N)
Structure
- SMILES
- OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@@H]3[C@H]2[C@@]2(CO)O[C@H]2[C@H]3OC(=O)c2ccc(c(c2)OC)O)[C@@H]([C@H]([C@@H]1O)O)O
- Molecular Formula:
- C23H28O13
- Molecular Weight:
- 512.461
- Log P:
- -2.0114
- Hydrogen Bond Acceptor:
- 13
- Hydrogen Bond Donor:
- 6
- TPSA:
- 197.13
- CAS Number(s):
- 39012-20-9
Synonym(s)
1.
picroside II
External Link(s)
| MeSH | C416837 |
| PubChem Compound | 11944602 |
| CHEMBL | CHEMBL510404 |
| ZINC | 8382348 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Chemical and Drug Induced Liver Injury | 15968718 | CTD |
Powered by :
Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120264
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.