Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LK0P1U
|
|||
| Ligand Name |
(3r,3as,4r,6ar)-4-[(2-Fluoroprop-2-En-1-Yl)oxy]hexahydrofuro[2,3-B]furan-3-Yl {(2s,3r)-3-Hydroxy-4-[{[2-(Methylamino)-1,3-Benzoxazol-6-Yl]sulfonyl}(2-Methylpropyl)amino]-1-Phenylbutan-2-Yl}carbamate
|
|||
| Synonyms |
(3r,3as,4r,6ar)-4-[(2-Fluoroprop-2-En-1-Yl)oxy]hexahydrofuro[2,3-B]furan-3-Yl {(2s,3r)-3-Hydroxy-4-[{[2-(Methylamino)-1,3-Benzoxazol-6-Yl]sulfonyl}(2-Methylpropyl)amino]-1-Phenylbutan-2-Yl}carbamate; CHEMBL3426613; Q27464727
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL
|
||
| Formula |
C32H41FN4O9S
|
|||
| Canonical SMILES |
CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2COC3C2C(CO3)OCC(=C)F)O)S(=O)(=O)C4=CC5=C(C=C4)N=C(O5)NC
|
|||
| InChI |
1S/C32H41FN4O9S/c1-19(2)14-37(47(40,41)22-10-11-23-26(13-22)45-31(34-4)35-23)15-25(38)24(12-21-8-6-5-7-9-21)36-32(39)46-28-18-44-30-29(28)27(17-43-30)42-16-20(3)33/h5-11,13,19,24-25,27-30,38H,3,12,14-18H2,1-2,4H3,(H,34,35)(H,36,39)/t24-,25+,27-,28-,29-,30+/m0/s1
|
|||
| InChIKey |
KIRATFTWNBTKGN-CFUDKJTHSA-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.