Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L4LB5J
|
|||
| Ligand Name |
(3s,5r)-N-{[9-(4-Methoxybutyl)-9h-Xanthen-9-Yl]methyl}-5-{[(4-Methylphenyl)sulfonyl]amino}piperidine-3-Carboxamide
|
|||
| Synonyms |
CHEMBL2322207; (3s,5r)-N-{[9-(4-Methoxybutyl)-9h-Xanthen-9-Yl]methyl}-5-{[(4-Methylphenyl)sulfonyl]amino}piperidine-3-Carboxamide; SCHEMBL4907824; BDBM50427040; Q27451248; (3S,5R)-N-[9-(4-Methoxybutyl)-9H-xanthene-9-ylmethyl]-5beta-[(p-tolylsulfonyl)amino]piperidine-3beta-carboxamide; 0N0
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C32H39N3O5S
|
|||
| Canonical SMILES |
CC1=CC=C(C=C1)S(=O)(=O)NC2CC(CNC2)C(=O)NCC3(C4=CC=CC=C4OC5=CC=CC=C53)CCCCOC
|
|||
| InChI |
1S/C32H39N3O5S/c1-23-13-15-26(16-14-23)41(37,38)35-25-19-24(20-33-21-25)31(36)34-22-32(17-7-8-18-39-2)27-9-3-5-11-29(27)40-30-12-6-4-10-28(30)32/h3-6,9-16,24-25,33,35H,7-8,17-22H2,1-2H3,(H,34,36)/t24-,25+/m0/s1
|
|||
| InChIKey |
LBPUIWQYAGTBDC-LOSJGSFVSA-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.