Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LM1JE3
|
|||
| Ligand Name |
methyl N-[(2S)-1-[2-[[4-[(3S)-3,4-dihydrothiophen-3-yl]phenyl]methyl]-2-[3-[(3R,6S,10Z)-3-hydroxy-4,7-dioxo-6-propan-2-yl-5,8-diazabicyclo[11.2.2]heptadeca-1(15),10,13,16-tetraen-3-yl]propyl]hydrazinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate
|
|||
| Structure |
 |
Download2D MOL
|
||
| Formula |
C40H55N5O6S
|
|||
| Canonical SMILES |
CC(C)C1C(=O)NCC=CCC2=CC=C(CC(C(=O)N1)(CCCN(CC3=CC=C(C=C3)C4CC=S=C4)NC(=O)C(C(C)(C)C)NC(=O)OC)O)C=C2
|
|||
| InChI |
1S/C40H55N5O6S/c1-27(2)33-35(46)41-21-8-7-10-28-11-13-29(14-12-28)24-40(50,37(48)42-33)20-9-22-45(44-36(47)34(39(3,4)5)43-38(49)51-6)25-30-15-17-31(18-16-30)32-19-23-52-26-32/h7-8,11-18,23,26-27,32-34,50H,9-10,19-22,24-25H2,1-6H3,(H,41,46)(H,42,48)(H,43,49)(H,44,47)/b8-7-/t32-,33+,34-,40-/m1/s1
|
|||
| InChIKey |
CCIGJYBWBZXKTK-ZFOWIRSQSA-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.