Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C7H13NO4S |
| Molecular Weight | 207.247 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(=O)N[C@@H](CSCCO)C(O)=O
InChI
InChIKey=NAYOYSKSFGMFOB-LURJTMIESA-N
InChI=1S/C7H13NO4S/c1-5(10)8-6(7(11)12)4-13-3-2-9/h6,9H,2-4H2,1H3,(H,8,10)(H,11,12)/t6-/m0/s1
| Molecular Formula | C7H13NO4S |
| Molecular Weight | 207.247 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Simultaneous determination of six mercapturic acid metabolites of volatile organic compounds in human urine. | 2009-06 |
|
| Simultaneous determination of mercapturic acids derived from ethylene oxide (HEMA), propylene oxide (2-HPMA), acrolein (3-HPMA), acrylamide (AAMA) and N,N-dimethylformamide (AMCC) in human urine using liquid chromatography/tandem mass spectrometry. | 2008-09 |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 18:51:44 GMT 2025
by
admin
on
Mon Mar 31 18:51:44 GMT 2025
|
| Record UNII |
5125C7A0EK
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| Record Status |
Validated (UNII)
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| Record Version |
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C73539
Created by
admin on Mon Mar 31 18:51:44 GMT 2025 , Edited by admin on Mon Mar 31 18:51:44 GMT 2025
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| Code System | Code | Type | Description | ||
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108009
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5125C7A0EK
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15060-26-1
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C107146
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admin on Mon Mar 31 18:51:44 GMT 2025 , Edited by admin on Mon Mar 31 18:51:44 GMT 2025
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PRIMARY | NCIT | ||
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DTXSID00914077
Created by
admin on Mon Mar 31 18:51:44 GMT 2025 , Edited by admin on Mon Mar 31 18:51:44 GMT 2025
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PRIMARY |