Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H15NO6S |
| Molecular Weight | 301.316 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CCC(O)=O)C(O)=O
InChI
InChIKey=KKOZKXBAPIYWAT-JTQLQIEISA-N
InChI=1S/C12H15NO6S/c1-8-2-4-9(5-3-8)20(18,19)13-10(12(16)17)6-7-11(14)15/h2-5,10,13H,6-7H2,1H3,(H,14,15)(H,16,17)/t10-/m0/s1
| Molecular Formula | C12H15NO6S |
| Molecular Weight | 301.316 |
| 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
Wed Apr 02 00:51:45 GMT 2025
by
admin
on
Wed Apr 02 00:51:45 GMT 2025
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| Record UNII |
2HXU3N9FF3
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| Record Status |
Validated (UNII)
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| Record Version |
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| Code System | Code | Type | Description | ||
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225-390-1
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admin on Wed Apr 02 00:51:45 GMT 2025 , Edited by admin on Wed Apr 02 00:51:45 GMT 2025
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2HXU3N9FF3
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admin on Wed Apr 02 00:51:45 GMT 2025 , Edited by admin on Wed Apr 02 00:51:45 GMT 2025
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2063452
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admin on Wed Apr 02 00:51:45 GMT 2025 , Edited by admin on Wed Apr 02 00:51:45 GMT 2025
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109186
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4816-80-2
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admin on Wed Apr 02 00:51:45 GMT 2025 , Edited by admin on Wed Apr 02 00:51:45 GMT 2025
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DTXSID301256419
Created by
admin on Wed Apr 02 00:51:45 GMT 2025 , Edited by admin on Wed Apr 02 00:51:45 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|