Details
Stereochemistry | ACHIRAL |
Molecular Formula | C4H4O4.2Na.6H2O |
Molecular Weight | 270.1434 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.O.O.O.[Na+].[Na+].[O-]C(=O)CCC([O-])=O
InChI
InChIKey=ZBTUYCUNQBRXOR-UHFFFAOYSA-L
InChI=1S/C4H6O4.2Na.6H2O/c5-3(6)1-2-4(7)8;;;;;;;;/h1-2H2,(H,5,6)(H,7,8);;;6*1H2/q;2*+1;;;;;;/p-2
Molecular Formula | C4H6O4 |
Molecular Weight | 118.088 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | H2O |
Molecular Weight | 18.0153 |
Charge | 0 |
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
Fri Dec 15 15:00:03 UTC 2023
by
admin
on
Fri Dec 15 15:00:03 UTC 2023
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Record UNII |
U16QOD6C4E
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C345
Created by
admin on Fri Dec 15 15:00:03 UTC 2023 , Edited by admin on Fri Dec 15 15:00:03 UTC 2023
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63686
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5200
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3083938
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1311370
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SUB12662MIG
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m10078
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C66554
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100000078266
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63675
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SUB12593MIG
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6106-21-4
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DTXSID70209942
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1311369
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U16QOD6C4E
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U16QOD6C4E
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CHEMBL1200345
Created by
admin on Fri Dec 15 15:00:03 UTC 2023 , Edited by admin on Fri Dec 15 15:00:03 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |