MONOPOTASSIUM ACONITATE, (E)-

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H3O6.K.2H
Molecular Weight	212.1986
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of MONOPOTASSIUM ACONITATE, (E)-

Structure Search

SMILES

[H+].[H+].[K+].[O-]C(=O)C\C(C([O-])=O)=C/C([O-])=O

InChI

InChIKey=YHWOBXOIFSCYAU-KSMVGCCESA-M

InChI=1S/C6H6O6.K/c7-4(8)1-3(6(11)12)2-5(9)10;/h1H,2H2,(H,7,8)(H,9,10)(H,11,12);/q;+1/p-1/b3-1+;

HIDE SMILES / InChI

Molecular Formula	K
Molecular Weight	39.0983
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C6H5O6
Molecular Weight	173.1003
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:13:26 GMT 2025` Edited by `admin` on `Mon Mar 31 23:13:26 GMT 2025`
Record UNII	BEJ8EJU24D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MONOPOTASSIUM ACONITATE, (E)-

Common Name

English

POTASSIUM DIHYDROGEN TRANS-ACONITATE

Preferred Name

English

1-PROPENE-1,2,3-TRICARBOXYLIC ACID, MONOPOTASSIUM SALT, (E)-

Systematic Name

English

POTASSIUM TRANS-ACONITATE (1:1)

Common Name

English

Code System Code Type Description

CAS

19143-25-0

Created by admin on Mon Mar 31 23:13:26 GMT 2025 , Edited by admin on Mon Mar 31 23:13:26 GMT 2025

NON-SPECIFIC STOICHIOMETRY

PUBCHEM

109374079

Created by admin on Mon Mar 31 23:13:26 GMT 2025 , Edited by admin on Mon Mar 31 23:13:26 GMT 2025

PRIMARY

FDA UNII

BEJ8EJU24D

Created by admin on Mon Mar 31 23:13:26 GMT 2025 , Edited by admin on Mon Mar 31 23:13:26 GMT 2025

PRIMARY

CAS

36516-84-4

Created by admin on Mon Mar 31 23:13:26 GMT 2025 , Edited by admin on Mon Mar 31 23:13:26 GMT 2025

PRIMARY