Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L7C0VQ
|
|||
| Ligand Name |
[(1'R)-1'-(4-{[(3R)-1-ethylpyrrolidin-3-yl]methoxy}phenyl)-6'-hydroxy-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl](phenyl)methanone
|
|||
| Synonyms |
[(1'R)-1'-(4-{[(3R)-1-ethylpyrrolidin-3-yl]methoxy}phenyl)-6'-hydroxy-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl](phenyl)methanone; TU9
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C31H34N2O3
|
|||
| Canonical SMILES |
CCN1CCC(C1)COC2=CC=C(C=C2)C3C4=C(CC5(N3C(=O)C6=CC=CC=C6)CC5)C=C(C=C4)O
|
|||
| InChI |
1S/C31H34N2O3/c1-2-32-17-14-22(20-32)21-36-27-11-8-23(9-12-27)29-28-13-10-26(34)18-25(28)19-31(15-16-31)33(29)30(35)24-6-4-3-5-7-24/h3-13,18,22,29,34H,2,14-17,19-21H2,1H3/t22-,29-/m1/s1
|
|||
| InChIKey |
HBXPPLITOLIFRU-KPURRNSFSA-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.