SODIUM 5,6-BENZYLIDENEASCORBATE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C13H11O6.Na
Molecular Weight	286.2126
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM 5,6-BENZYLIDENEASCORBATE

Structure Search

SMILES

[Na+].[H][C@]1(COC(O1)C2=CC=CC=C2)[C@@]3([H])OC(=O)C(O)=C3[O-]

InChI

InChIKey=JLUAVHQVEFDQEO-ZKZAMAJLSA-M

InChI=1S/C13H12O6.Na/c14-9-10(15)12(16)19-11(9)8-6-17-13(18-8)7-4-2-1-3-5-7;/h1-5,8,11,13-15H,6H2;/q;+1/p-1/t8-,11+,13?;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C13H11O6
Molecular Weight	263.2228
Charge	-1
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

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

Approval Year

PubMed

Title	Date	PubMed
Sodium benzylideneascorbate induces apoptosis in HIV-replicating U1 cells.	1994 Aug 29	8076675

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:34:52 GMT 2023` Edited by `admin` on `Sat Dec 16 08:34:52 GMT 2023`
Record UNII	2M55S7ZFFQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM 5,6-BENZYLIDENEASCORBATE

Common Name

English

L-ASCORBIC ACID, 5,6-O-(PHENYLMETHYLENE)-, SODIUM SALT (1:1)

Common Name

English

L-ASCORBIC ACID, 5,6-O-(PHENYLMETHYLENE)-, MONOSODIUM SALT

Common Name

English

SODIUM 5,6-BENZYLIDENE-L-ASCORBATE

Common Name

English

Code System Code Type Description

CAS

98734-55-5

Created by admin on Sat Dec 16 08:34:52 GMT 2023 , Edited by admin on Sat Dec 16 08:34:52 GMT 2023

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FDA UNII

2M55S7ZFFQ

Created by admin on Sat Dec 16 08:34:52 GMT 2023 , Edited by admin on Sat Dec 16 08:34:52 GMT 2023

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PUBCHEM

71587369

Created by admin on Sat Dec 16 08:34:52 GMT 2023 , Edited by admin on Sat Dec 16 08:34:52 GMT 2023

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EPA CompTox

DTXSID50243788

Created by admin on Sat Dec 16 08:34:52 GMT 2023 , Edited by admin on Sat Dec 16 08:34:52 GMT 2023

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