Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C20H20F3NO4S |
| Molecular Weight | 427.437 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(C=C(CC(SC)C(O)=O)C=C1)C(=O)NCC2=CC=C(C=C2)C(F)(F)F
InChI
InChIKey=MHFJPNQXKJETTQ-UHFFFAOYSA-N
InChI=1S/C20H20F3NO4S/c1-28-16-8-5-13(10-17(29-2)19(26)27)9-15(16)18(25)24-11-12-3-6-14(7-4-12)20(21,22)23/h3-9,17H,10-11H2,1-2H3,(H,24,25)(H,26,27)
| Molecular Formula | C20H20F3NO4S |
| Molecular Weight | 427.437 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 08:08:54 GMT 2025
by
admin
on
Wed Apr 02 08:08:54 GMT 2025
|
| Record UNII |
SAJ850V1D7
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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SAJ850V1D7
Created by
admin on Wed Apr 02 08:08:54 GMT 2025 , Edited by admin on Wed Apr 02 08:08:54 GMT 2025
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9802598
Created by
admin on Wed Apr 02 08:08:54 GMT 2025 , Edited by admin on Wed Apr 02 08:08:54 GMT 2025
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330861-64-8
Created by
admin on Wed Apr 02 08:08:54 GMT 2025 , Edited by admin on Wed Apr 02 08:08:54 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
FECAL
|