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Details

Stereochemistry RACEMIC
Molecular Formula 2C6H11O3.Ca
Molecular Weight 302.377
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DL-LEUCIC ACID CALCIUM

SMILES

[Ca++].CC(C)CC(O)C([O-])=O.CC(C)CC(O)C([O-])=O

InChI

InChIKey=IJZMJUAFAPHDSX-UHFFFAOYSA-L
InChI=1S/2C6H12O3.Ca/c2*1-4(2)3-5(7)6(8)9;/h2*4-5,7H,3H2,1-2H3,(H,8,9);/q;;+2/p-2

HIDE SMILES / InChI

Approval Year

Name Type Language
DL-LEUCIC ACID CALCIUM
Common Name English
PENTANOIC ACID, 2-HYDROXY-4-METHYL-, CALCIUM SALT (2:1)
Systematic Name English
LEUCIC ACID CALCIUM, (±)-
Common Name English
CALCIUM (1)-BIS(2-HYDROXY-4-METHYLVALERATE)
Common Name English
CALCIUM 4-METHYL-2-HYDROXYPENTANOATE, (±)-
Systematic Name English
Code System Code Type Description
FDA UNII
S082A4WIXR
Created by admin on Sat Dec 16 11:14:02 GMT 2023 , Edited by admin on Sat Dec 16 11:14:02 GMT 2023
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CAS
93778-33-7
Created by admin on Sat Dec 16 11:14:02 GMT 2023 , Edited by admin on Sat Dec 16 11:14:02 GMT 2023
PRIMARY
PUBCHEM
44146369
Created by admin on Sat Dec 16 11:14:02 GMT 2023 , Edited by admin on Sat Dec 16 11:14:02 GMT 2023
PRIMARY
EPA CompTox
DTXSID80918018
Created by admin on Sat Dec 16 11:14:02 GMT 2023 , Edited by admin on Sat Dec 16 11:14:02 GMT 2023
PRIMARY