Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L4D1IX
|
|||
| Ligand Name |
(3S)-6'-chloro-5-(cyclobutylmethyl)-3',4,4',5-tetrahydro-2H,2'H-spiro[1,5-benzoxazepine-3,1'-naphthalene]-7-carboxylic acid
|
|||
| Synonyms |
CHEMBL4515030; SCHEMBL23689532; BDBM50514211; (3S)-6'-chloro-5-(cyclobutylmethyl)-3',4,4',5-tetrahydro-2H,2'H-spiro[1,5-benzoxazepine-3,1'-naphthalene]-7-carboxylic acid; Q54
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C24H26ClNO3
|
|||
| Canonical SMILES |
C1CC(C1)CN2CC3(CCCC4=C3C=CC(=C4)Cl)COC5=C2C=C(C=C5)C(=O)O
|
|||
| InChI |
1S/C24H26ClNO3/c25-19-7-8-20-17(11-19)5-2-10-24(20)14-26(13-16-3-1-4-16)21-12-18(23(27)28)6-9-22(21)29-15-24/h6-9,11-12,16H,1-5,10,13-15H2,(H,27,28)/t24-/m0/s1
|
|||
| InChIKey |
UZONKUOJBLOPMC-DEOSSOPVSA-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.