DL-LEUCIC ACID CALCIUM

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 Search

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

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	C6H11O3
Molecular Weight	131.1497
Charge	-1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:14:02 GMT 2023` Edited by `admin` on `Sat Dec 16 11:14:02 GMT 2023`
Record UNII	S082A4WIXR
Record Status	`Validated (UNII)`
Record Version

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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

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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

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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

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