DIFLUNISAL DIMER

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H15F3O6
Molecular Weight	480.3889
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)C1=CC(=CC=C1O)C2=CC=C(F)C=C2OC3=C(C=C(C=C3)C4=CC=C(F)C=C4F)C(O)=O

InChI

InChIKey=ZVGDOVVKVQGQQP-UHFFFAOYSA-N

InChI=1S/C26H15F3O6/c27-15-3-5-17(21(29)11-15)13-2-8-23(20(10-13)26(33)34)35-24-12-16(28)4-6-18(24)14-1-7-22(30)19(9-14)25(31)32/h1-12,30H,(H,31,32)(H,33,34)

HIDE SMILES / InChI

Molecular Formula	C26H15F3O6
Molecular Weight	480.3889
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 `Sat Dec 16 14:21:15 UTC 2023` Edited by `admin` on `Sat Dec 16 14:21:15 UTC 2023`
Record UNII	S0QM21DBC7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIFLUNISAL DIMER

Common Name

English

(1,1'-BIPHENYL)-3-CARBOXYLIC ACID, 2'-((3-CARBOXY-2',4'-DIFLUORO(1,1'-BIPHENYL)-4-YL)OXY)-4'-FLUORO-4-HYDROXY-

Systematic Name

English

2'-((3-CARBOXY-2',4'-DIFLUORO(1,1'-BIPHENYL)-4-YL)OXY)-4'-FLUORO-4-HYDROXY(1,1'-BIPHENYL)-3-CARBOXYLIC ACID

Systematic Name

English

Code System Code Type Description

PUBCHEM

154572888

Created by admin on Sat Dec 16 14:21:15 UTC 2023 , Edited by admin on Sat Dec 16 14:21:15 UTC 2023

PRIMARY

CAS

137132-71-9

Created by admin on Sat Dec 16 14:21:15 UTC 2023 , Edited by admin on Sat Dec 16 14:21:15 UTC 2023

PRIMARY

FDA UNII

S0QM21DBC7

Created by admin on Sat Dec 16 14:21:15 UTC 2023 , Edited by admin on Sat Dec 16 14:21:15 UTC 2023

PRIMARY

Related Record Type Details


					7C546U4DEN

DIFLUNISAL

PARENT -> DEGRADENT

Comments:

Degradent product of SRN1 degradation process.