SODIUM GENTISATE HYDRATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H5O4.Na.H2O
Molecular Weight	194.1172
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.[Na+].OC1=CC(C([O-])=O)=C(O)C=C1

InChI

InChIKey=SYGYBOPDUUSVNE-UHFFFAOYSA-M

InChI=1S/C7H6O4.Na.H2O/c8-4-1-2-6(9)5(3-4)7(10)11;;/h1-3,8-9H,(H,10,11);;1H2/q;+1;/p-1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	HO
Molecular Weight	17.0073
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C7H6O4
Molecular Weight	154.1201
Charge	0
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 15:57:11 UTC 2023` Edited by `admin` on `Fri Dec 15 15:57:11 UTC 2023`
Record UNII	Y75S7S5FI3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM GENTISATE HYDRATE

Systematic Name

English

GENTISIC ACID SODIUM SALT HYDRATE

Common Name

English

SODIUM GENTISATE [MART.]

Common Name

English

Code System Code Type Description

NCI_THESAURUS

C45678

Created by admin on Fri Dec 15 15:57:11 UTC 2023 , Edited by admin on Fri Dec 15 15:57:11 UTC 2023

CONCEPT

Industrial Aid

NCI_THESAURUS

C80942

Created by admin on Fri Dec 15 15:57:11 UTC 2023 , Edited by admin on Fri Dec 15 15:57:11 UTC 2023

PRIMARY

PUBCHEM

43835012

Created by admin on Fri Dec 15 15:57:11 UTC 2023 , Edited by admin on Fri Dec 15 15:57:11 UTC 2023

PRIMARY

FDA UNII

Y75S7S5FI3

Created by admin on Fri Dec 15 15:57:11 UTC 2023 , Edited by admin on Fri Dec 15 15:57:11 UTC 2023

PRIMARY

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