Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C25H31F3O5S |
| Molecular Weight | 500.571 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCC(=O)O[C@@]1([C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=S)OCF
InChI
InChIKey=DDOJYRCALRCAOK-CENSZEJFSA-N
InChI=1S/C25H31F3O5S/c1-5-20(31)33-25(21(34)32-12-26)13(2)8-15-16-10-18(27)17-9-14(29)6-7-22(17,3)24(16,28)19(30)11-23(15,25)4/h6-7,9,13,15-16,18-19,30H,5,8,10-12H2,1-4H3/t13-,15+,16+,18+,19+,22+,23+,24+,25+/m1/s1
| Molecular Formula | C25H31F3O5S |
| Molecular Weight | 500.571 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:41:37 GMT 2025
by
admin
on
Mon Mar 31 23:41:37 GMT 2025
|
| Record UNII |
CC8AR5RHS2
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Systematic Name | English | ||
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Preferred Name | English |
| Code System | Code | Type | Description | ||
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CC8AR5RHS2
Created by
admin on Mon Mar 31 23:41:37 GMT 2025 , Edited by admin on Mon Mar 31 23:41:37 GMT 2025
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PRIMARY | |||
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87637746
Created by
admin on Mon Mar 31 23:41:37 GMT 2025 , Edited by admin on Mon Mar 31 23:41:37 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> IMPURITY |
sum of impurities J and K: maximum 0.15 per cent
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
