Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L79XWA
|
|||
| Ligand Name |
tert-butyl [(2S)-1-{[(2R)-1-oxo-3-phenyl-1-{[3-(pyridin-4-yl)propyl]amino}propan-2-yl]sulfanyl}-3-phenylpropan-2-yl]carbamate
|
|||
| Synonyms |
tert-butyl [(2S)-1-{[(2R)-1-oxo-3-phenyl-1-{[3-(pyridin-4-yl)propyl]amino}propan-2-yl]sulfanyl}-3-phenylpropan-2-yl]carbamate; NI6
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL
|
||
| Formula |
C31H39N3O3S
|
|||
| Canonical SMILES |
CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CSC(CC2=CC=CC=C2)C(=O)NCCCC3=CC=NC=C3
|
|||
| InChI |
1S/C31H39N3O3S/c1-31(2,3)37-30(36)34-27(21-25-11-6-4-7-12-25)23-38-28(22-26-13-8-5-9-14-26)29(35)33-18-10-15-24-16-19-32-20-17-24/h4-9,11-14,16-17,19-20,27-28H,10,15,18,21-23H2,1-3H3,(H,33,35)(H,34,36)/t27-,28+/m0/s1
|
|||
| InChIKey |
HIUHMRVLQNHDQV-WUFINQPMSA-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.