Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C11H14N2O4S.C2HF3O2 |
| Molecular Weight | 384.328 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(F)(F)F.CC(=O)NC1=CC=C(O)C(SC[C@H](N)C(O)=O)=C1
InChI
InChIKey=PDZGEXMJHANKLR-QRPNPIFTSA-N
InChI=1S/C11H14N2O4S.C2HF3O2/c1-6(14)13-7-2-3-9(15)10(4-7)18-5-8(12)11(16)17;3-2(4,5)1(6)7/h2-4,8,15H,5,12H2,1H3,(H,13,14)(H,16,17);(H,6,7)/t8-;/m0./s1
| Molecular Formula | C2HF3O2 |
| Molecular Weight | 114.0233 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C11H14N2O4S |
| Molecular Weight | 270.305 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 20:22:07 UTC 2023
by
admin
on
Sat Dec 16 20:22:07 UTC 2023
|
| Record UNII |
7K972YWH9T
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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57350642
Created by
admin on Sat Dec 16 20:22:07 UTC 2023 , Edited by admin on Sat Dec 16 20:22:07 UTC 2023
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1331891-93-0
Created by
admin on Sat Dec 16 20:22:07 UTC 2023 , Edited by admin on Sat Dec 16 20:22:07 UTC 2023
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PRIMARY | |||
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7K972YWH9T
Created by
admin on Sat Dec 16 20:22:07 UTC 2023 , Edited by admin on Sat Dec 16 20:22:07 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
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