Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L3QMK2
|
|||
| Ligand Name |
8-(5~{H}-[1,3]dioxolo[4,5-f]benzimidazol-6-ylmethyl)-7-(phenylmethyl)-3-propyl-purine-2,6-dione
|
|||
| Synonyms |
8-(5~{H}-[1,3]dioxolo[4,5-f]benzimidazol-6-ylmethyl)-7-(phenylmethyl)-3-propyl-purine-2,6-dione; SCHEMBL18039283; IVQ
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C24H22N6O4
|
|||
| Canonical SMILES |
CCCN1C2=C(C(=O)NC1=O)N(C(=N2)CC3=NC4=CC5=C(C=C4N3)OCO5)CC6=CC=CC=C6
|
|||
| InChI |
1S/C24H22N6O4/c1-2-8-29-22-21(23(31)28-24(29)32)30(12-14-6-4-3-5-7-14)20(27-22)11-19-25-15-9-17-18(34-13-33-17)10-16(15)26-19/h3-7,9-10H,2,8,11-13H2,1H3,(H,25,26)(H,28,31,32)
|
|||
| InChIKey |
DXPLGNDECHMRIY-UHFFFAOYSA-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.