Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C25H27F4N3O4S |
| Molecular Weight | 541.558 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(F)(CO)C[C@H](N[C@@H](C1=CC=C(C=C1)C2=CC=C(C=C2)S(C)(=O)=O)C(F)(F)F)C(=O)NC3(CC3)C#N
InChI
InChIKey=JCZDLZKSPMKOPS-MMBKUXRPSA-N
InChI=1S/C25H27F4N3O4S/c1-23(26,15-33)13-20(22(34)32-24(14-30)11-12-24)31-21(25(27,28)29)18-5-3-16(4-6-18)17-7-9-19(10-8-17)37(2,35)36/h3-10,20-21,31,33H,11-13,15H2,1-2H3,(H,32,34)/t20-,21-,23?/m0/s1
| Molecular Formula | C25H27F4N3O4S |
| Molecular Weight | 541.558 |
| Charge | 0 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 13:40:01 GMT 2025
by
admin
on
Wed Apr 02 13:40:01 GMT 2025
|
| Record UNII |
26LLW37JEH
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Systematic Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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26LLW37JEH
Created by
admin on Wed Apr 02 13:40:01 GMT 2025 , Edited by admin on Wed Apr 02 13:40:01 GMT 2025
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PRIMARY | |||
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156596462
Created by
admin on Wed Apr 02 13:40:01 GMT 2025 , Edited by admin on Wed Apr 02 13:40:01 GMT 2025
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1356006-28-4
Created by
admin on Wed Apr 02 13:40:01 GMT 2025 , Edited by admin on Wed Apr 02 13:40:01 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
|
PARENT -> METABOLITE |
URINE
|
||
|
PARENT -> METABOLITE |
FECAL
|
