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Details

Stereochemistry EPIMERIC
Molecular Formula 4C6H11O7.6C3H5O3.5Ca
Molecular Weight 1515.399
Optical Activity UNSPECIFIED
Defined Stereocenters 16 / 22
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM LACTATE GLUCONATE ANHYDROUS

SMILES

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

InChI

InChIKey=SKFJKZHRPGEDGP-WUQPKBQTSA-D
InChI=1S/4C6H12O7.6C3H6O3.5Ca/c4*7-1-2(8)3(9)4(10)5(11)6(12)13;6*1-2(4)3(5)6;;;;;/h4*2-5,7-11H,1H2,(H,12,13);6*2,4H,1H3,(H,5,6);;;;;/q;;;;;;;;;;5*+2/p-10/t4*2-,3-,4+,5-;;;;;;;;;;;/m1111.........../s1

HIDE SMILES / InChI

Molecular Formula C6H11O7
Molecular Weight 195.1473
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C3H5O3
Molecular Weight 89.07
Charge -1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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 Fri Dec 15 15:25:40 UTC 2023
Edited
by admin
on Fri Dec 15 15:25:40 UTC 2023
Record UNII
1VUQ647164
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALCIUM LACTATE GLUCONATE ANHYDROUS
Common Name English
CALCIUM DL-LACTATE MIXTURE WITH D-GLUCONIC ACID, CALCIUM SALT (2:1)
Common Name English
D-GLUCONIC ACID, CALCIUM SALT (2:1), MIXT. WITH CALCIUM 2-HYDROXYPROPANOATE (1:2)
Systematic Name English
Code System Code Type Description
SMS_ID
100000090512
Created by admin on Fri Dec 15 15:25:40 UTC 2023 , Edited by admin on Fri Dec 15 15:25:40 UTC 2023
PRIMARY
CAS
11116-97-5
Created by admin on Fri Dec 15 15:25:40 UTC 2023 , Edited by admin on Fri Dec 15 15:25:40 UTC 2023
NON-SPECIFIC STOICHIOMETRY
PUBCHEM
76963631
Created by admin on Fri Dec 15 15:25:40 UTC 2023 , Edited by admin on Fri Dec 15 15:25:40 UTC 2023
PRIMARY
FDA UNII
1VUQ647164
Created by admin on Fri Dec 15 15:25:40 UTC 2023 , Edited by admin on Fri Dec 15 15:25:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID50966445
Created by admin on Fri Dec 15 15:25:40 UTC 2023 , Edited by admin on Fri Dec 15 15:25:40 UTC 2023
PRIMARY
CAS
52080-72-5
Created by admin on Fri Dec 15 15:25:40 UTC 2023 , Edited by admin on Fri Dec 15 15:25:40 UTC 2023
NON-SPECIFIC STOICHIOMETRY
Related Record Type Details
SOLVATE->ANHYDROUS
Related Record Type Details
ACTIVE MOIETY