Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C6H9O3.Ca |
| Molecular Weight | 298.346 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CC[C@H](C)C(=O)C([O-])=O.CC[C@H](C)C(=O)C([O-])=O
InChI
InChIKey=PTFSVYLXDCGPFY-SCGRZTRASA-L
InChI=1S/2C6H10O3.Ca/c2*1-3-4(2)5(7)6(8)9;/h2*4H,3H2,1-2H3,(H,8,9);/q;;+2/p-2/t2*4-;/m00./s1
| Molecular Formula | C6H9O3 |
| Molecular Weight | 129.1339 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 19:44:20 GMT 2025
by
admin
on
Mon Mar 31 19:44:20 GMT 2025
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| Record UNII |
85RJ2N890T
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Code System | Code | Type | Description | ||
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100000088160
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85RJ2N890T
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257-458-1
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DTXSID20199788
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admin on Mon Mar 31 19:44:20 GMT 2025 , Edited by admin on Mon Mar 31 19:44:20 GMT 2025
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21149466
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admin on Mon Mar 31 19:44:20 GMT 2025 , Edited by admin on Mon Mar 31 19:44:20 GMT 2025
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51828-96-7
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admin on Mon Mar 31 19:44:20 GMT 2025 , Edited by admin on Mon Mar 31 19:44:20 GMT 2025
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SUB22988
Created by
admin on Mon Mar 31 19:44:20 GMT 2025 , Edited by admin on Mon Mar 31 19:44:20 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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