Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C6H9O3.Ca.2H2O |
Molecular Weight | 334.376 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.[Ca++].CC(C)CC(=O)C([O-])=O.CC(C)CC(=O)C([O-])=O
InChI
InChIKey=ZDWTWIPSCCEWEZ-UHFFFAOYSA-L
InChI=1S/2C6H10O3.Ca.2H2O/c2*1-4(2)3-5(7)6(8)9;;;/h2*4H,3H2,1-2H3,(H,8,9);;2*1H2/q;;+2;;/p-2
Approval Year
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352538-33-1
Created by
admin on Sat Dec 16 09:09:51 GMT 2023 , Edited by admin on Sat Dec 16 09:09:51 GMT 2023
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Y5VW6O1P4I
Created by
admin on Sat Dec 16 09:09:51 GMT 2023 , Edited by admin on Sat Dec 16 09:09:51 GMT 2023
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16218381
Created by
admin on Sat Dec 16 09:09:51 GMT 2023 , Edited by admin on Sat Dec 16 09:09:51 GMT 2023
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PRIMARY |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD