Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H17NO6S |
| Molecular Weight | 303.331 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H](O)[C@H]([C@H]1S\C(=C/CCCO)C(=N1)C(O)=O)C(O)=O
InChI
InChIKey=BOALIGCXNFYTIN-MSZSNGJQSA-N
InChI=1S/C12H17NO6S/c1-6(15)8(11(16)17)10-13-9(12(18)19)7(20-10)4-2-3-5-14/h4,6,8,10,14-15H,2-3,5H2,1H3,(H,16,17)(H,18,19)/b7-4-/t6-,8-,10-/m1/s1
| Molecular Formula | C12H17NO6S |
| Molecular Weight | 303.331 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 17:19:21 GMT 2025
by
admin
on
Wed Apr 02 17:19:21 GMT 2025
|
| Record UNII |
P6NPV65QAD
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Preferred Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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P6NPV65QAD
Created by
admin on Wed Apr 02 17:19:21 GMT 2025 , Edited by admin on Wed Apr 02 17:19:21 GMT 2025
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PRIMARY | |||
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774505-06-5
Created by
admin on Wed Apr 02 17:19:21 GMT 2025 , Edited by admin on Wed Apr 02 17:19:21 GMT 2025
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10870403
Created by
admin on Wed Apr 02 17:19:21 GMT 2025 , Edited by admin on Wed Apr 02 17:19:21 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
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