Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C6H8O8.Ca.4H2O |
Molecular Weight | 320.262 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.O.[Ca++].O[C@@H]([C@H](O)[C@@H](O)C([O-])=O)[C@H](O)C([O-])=O
InChI
InChIKey=ZQWFSIZRQANUDA-WQMSYZFBSA-L
InChI=1S/C6H10O8.Ca.4H2O/c7-1(3(9)5(11)12)2(8)4(10)6(13)14;;;;;/h1-4,7-10H,(H,11,12)(H,13,14);;4*1H2/q;+2;;;;/p-2/t1-,2-,3-,4+;;;;;/m0...../s1
Molecular Formula | C6H10O8 |
Molecular Weight | 210.1388 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | Ca |
Molecular Weight | 40.078 |
Charge | 2 |
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 16:19:09 UTC 2023
by
admin
on
Fri Dec 15 16:19:09 UTC 2023
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Record UNII |
6AP9J91K4V
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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 |
C1017
Created by
admin on Fri Dec 15 16:19:09 UTC 2023 , Edited by admin on Fri Dec 15 16:19:09 UTC 2023
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Code System | Code | Type | Description | ||
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DTXSID70206633
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6AP9J91K4V
Created by
admin on Fri Dec 15 16:19:09 UTC 2023 , Edited by admin on Fri Dec 15 16:19:09 UTC 2023
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C335
Created by
admin on Fri Dec 15 16:19:09 UTC 2023 , Edited by admin on Fri Dec 15 16:19:09 UTC 2023
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5793-89-5
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DB13962
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1087202
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SUB178774
Created by
admin on Fri Dec 15 16:19:09 UTC 2023 , Edited by admin on Fri Dec 15 16:19:09 UTC 2023
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236693
Created by
admin on Fri Dec 15 16:19:09 UTC 2023 , Edited by admin on Fri Dec 15 16:19:09 UTC 2023
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6AP9J91K4V
Created by
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CHEMBL2104217
Created by
admin on Fri Dec 15 16:19:09 UTC 2023 , Edited by admin on Fri Dec 15 16:19:09 UTC 2023
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11954337
Created by
admin on Fri Dec 15 16:19:09 UTC 2023 , Edited by admin on Fri Dec 15 16:19:09 UTC 2023
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100000164383
Created by
admin on Fri Dec 15 16:19:09 UTC 2023 , Edited by admin on Fri Dec 15 16:19:09 UTC 2023
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Related Record | Type | Details | ||
---|---|---|---|---|
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ANHYDROUS->SOLVATE |
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PARENT -> SALT/SOLVATE |