Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C4H5NO4.2C3H6NO2S.Fe.2H |
| Molecular Weight | 560.335 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | -2 |
SHOW SMILES / InChI
SMILES
[H+].[H+].[Fe++].N[C@@H](CS)C([O-])=O.N[C@@H](CS)C([O-])=O.N[C@@H](CC([O-])=O)C([O-])=O.N[C@@H](CC([O-])=O)C([O-])=O
InChI
InChIKey=RACKTDPDSGSFJJ-YGYANBGASA-J
InChI=1S/2C4H7NO4.2C3H7NO2S.Fe/c2*5-2(4(8)9)1-3(6)7;2*4-2(1-7)3(5)6;/h2*2H,1,5H2,(H,6,7)(H,8,9);2*2,7H,1,4H2,(H,5,6);/q;;;;+2/p-4/t4*2-;/m0000./s1
| Molecular Formula | C4H5NO4 |
| Molecular Weight | 131.0868 |
| Charge | -2 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C3H6NO2S |
| Molecular Weight | 120.15 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | H |
| Molecular Weight | 1.0079 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | Fe |
| Molecular Weight | 55.845 |
| Charge | 2 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 08:32:45 UTC 2023
by
admin
on
Sat Dec 16 08:32:45 UTC 2023
|
| Record UNII |
M450PPB891
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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M450PPB891
Created by
admin on Sat Dec 16 08:32:45 UTC 2023 , Edited by admin on Sat Dec 16 08:32:45 UTC 2023
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76967544
Created by
admin on Sat Dec 16 08:32:45 UTC 2023 , Edited by admin on Sat Dec 16 08:32:45 UTC 2023
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PRIMARY |