Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L9MX6F
|
|||
| Ligand Name |
Keap1-Nrf2-IN-5
|
|||
| Synonyms |
Keap1-Nrf2-IN-5; CHEMBL4757224; (5S,8R)-8-[[(2S)-1-ethanoylpyrrolidin-2-yl]carbonylamino]-N,N-dimethyl-7,11-bis(oxidanylidene)-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxamide; BDBM50556867; HY-143892; CS-0376678; Q9E
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C23H30N4O6S
|
|||
| Canonical SMILES |
CC(=O)N1CCCC1C(=O)NC2COC(=O)C3=CC=CC=C3CSCC(NC2=O)C(=O)N(C)C
|
|||
| InChI |
1S/C23H30N4O6S/c1-14(28)27-10-6-9-19(27)21(30)24-17-11-33-23(32)16-8-5-4-7-15(16)12-34-13-18(25-20(17)29)22(31)26(2)3/h4-5,7-8,17-19H,6,9-13H2,1-3H3,(H,24,30)(H,25,29)/t17-,18-,19+/m1/s1
|
|||
| InChIKey |
URYMNBQTISFUDY-QRVBRYPASA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.