Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C6H10O12P2.3Na.H.8H2O |
Molecular Weight | 550.1834 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H+].O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+].O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H](O)C(=O)COP([O-])([O-])=O
InChI
InChIKey=BUMXRRGJJDMPRT-PESUWTOCSA-K
InChI=1S/C6H14O12P2.3Na.8H2O/c7-3(1-17-19(11,12)13)5(9)6(10)4(8)2-18-20(14,15)16;;;;;;;;;;;/h3,5-7,9-10H,1-2H2,(H2,11,12,13)(H2,14,15,16);;;;8*1H2/q;3*+1;;;;;;;;/p-3/t3-,5-,6-;;;;;;;;;;;/m1.........../s1
Molecular Formula | C6H10O12P2.3Na.H.8H2O |
Molecular Weight | 550.1834 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C6H14O12P2 |
Molecular Weight | 340.1157 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
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 |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:25:37 UTC 2023
by
admin
on
Fri Dec 15 15:25:37 UTC 2023
|
Record UNII |
463VBZ2YVD
|
Record Status |
Validated (UNII)
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Record Version |
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-
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102416-04-6
Created by
admin on Fri Dec 15 15:25:38 UTC 2023 , Edited by admin on Fri Dec 15 15:25:38 UTC 2023
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ALTERNATIVE | |||
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81028-91-3
Created by
admin on Fri Dec 15 15:25:38 UTC 2023 , Edited by admin on Fri Dec 15 15:25:38 UTC 2023
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JJ-98
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CHEMBL97893
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admin on Fri Dec 15 15:25:38 UTC 2023 , Edited by admin on Fri Dec 15 15:25:38 UTC 2023
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SUB75699
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admin on Fri Dec 15 15:25:38 UTC 2023 , Edited by admin on Fri Dec 15 15:25:38 UTC 2023
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300000040281
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admin on Fri Dec 15 15:25:38 UTC 2023 , Edited by admin on Fri Dec 15 15:25:38 UTC 2023
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76967543
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admin on Fri Dec 15 15:25:38 UTC 2023 , Edited by admin on Fri Dec 15 15:25:38 UTC 2023
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C166727
Created by
admin on Fri Dec 15 15:25:38 UTC 2023 , Edited by admin on Fri Dec 15 15:25:38 UTC 2023
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DTXSID801001716
Created by
admin on Fri Dec 15 15:25:38 UTC 2023 , Edited by admin on Fri Dec 15 15:25:38 UTC 2023
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463VBZ2YVD
Created by
admin on Fri Dec 15 15:25:38 UTC 2023 , Edited by admin on Fri Dec 15 15:25:38 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 |