Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C7H12NO3S.Mn |
Molecular Weight | 435.418 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Mn++].CSCC[C@H](NC(C)=O)C([O-])=O.CSCC[C@H](NC(C)=O)C([O-])=O
InChI
InChIKey=NCOMLKYSJHLANH-UAIGZDOSSA-L
InChI=1S/2C7H13NO3S.Mn/c2*1-5(9)8-6(7(10)11)3-4-12-2;/h2*6H,3-4H2,1-2H3,(H,8,9)(H,10,11);/q;;+2/p-2/t2*6-;/m00./s1
Molecular Formula | Mn |
Molecular Weight | 54.938 |
Charge | 2 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C7H12NO3S |
Molecular Weight | 190.24 |
Charge | -1 |
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 01:36:31 GMT 2023
by
admin
on
Sat Dec 16 01:36:31 GMT 2023
|
Record UNII |
DTP8912DTL
|
Record Status |
Validated (UNII)
|
Record Version |
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-
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Code System | Code | Type | Description | ||
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71587405
Created by
admin on Sat Dec 16 01:36:31 GMT 2023 , Edited by admin on Sat Dec 16 01:36:31 GMT 2023
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PRIMARY | |||
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DTXSID401019690
Created by
admin on Sat Dec 16 01:36:31 GMT 2023 , Edited by admin on Sat Dec 16 01:36:31 GMT 2023
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105883-50-9
Created by
admin on Sat Dec 16 01:36:31 GMT 2023 , Edited by admin on Sat Dec 16 01:36:31 GMT 2023
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PRIMARY | |||
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DTP8912DTL
Created by
admin on Sat Dec 16 01:36:31 GMT 2023 , Edited by admin on Sat Dec 16 01:36:31 GMT 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |