Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C22H28FN3O6S |
| Molecular Weight | 481.538 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)C1=C(\C=C\[C@H](O)C[C@@H](O)CC(O)=O)C(=NC(=N1)N(C)S(C)(=O)=O)C2=CC=C(F)C=C2
InChI
InChIKey=BPRHUIZQVSMCRT-YXWZHEERSA-N
InChI=1S/C22H28FN3O6S/c1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t16-,17+/m0/s1
| Molecular Formula | C22H28FN3O6S |
| Molecular Weight | 481.538 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:00:46 UTC 2023
by
admin
on
Sat Dec 16 19:00:46 UTC 2023
|
| Record UNII |
K637T66PWQ
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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| Code System | Code | Type | Description | ||
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K637T66PWQ
Created by
admin on Sat Dec 16 19:00:46 UTC 2023 , Edited by admin on Sat Dec 16 19:00:46 UTC 2023
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PRIMARY | |||
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1094100-06-7
Created by
admin on Sat Dec 16 19:00:46 UTC 2023 , Edited by admin on Sat Dec 16 19:00:46 UTC 2023
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6439133
Created by
admin on Sat Dec 16 19:00:46 UTC 2023 , Edited by admin on Sat Dec 16 19:00:46 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
Ph.Eur.; USP
|
||
|
PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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