2,2?,2??-[[2-[(2E)-3-[4-(Carboxymethoxy)phenyl]-1-oxo-2-propen-1-yl]-1,3,5-benzenetriyl]tris(oxy)]tris[acetic acid]

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H20O13
Molecular Weight	504.3971
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 2,2?,2??-[[2-[(2E)-3-[4-(Carboxymethoxy)phenyl]-1-oxo-2-propen-1-yl]-1,3,5-benzenetriyl]tris(oxy)]tris[acetic acid]

Structure Search

SMILES

OC(=O)COC1=CC=C(\C=C\C(=O)C2=C(OCC(O)=O)C=C(OCC(O)=O)C=C2OCC(O)=O)C=C1

InChI

InChIKey=JNGITPZNUVUHLN-ZZXKWVIFSA-N

InChI=1S/C23H20O13/c24-16(6-3-13-1-4-14(5-2-13)33-9-19(25)26)23-17(35-11-21(29)30)7-15(34-10-20(27)28)8-18(23)36-12-22(31)32/h1-8H,9-12H2,(H,25,26)(H,27,28)(H,29,30)(H,31,32)/b6-3+

HIDE SMILES / InChI

Molecular Formula	C23H20O13
Molecular Weight	504.3971
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:56:21 GMT 2025` Edited by `admin` on `Wed Apr 02 20:56:21 GMT 2025`
Record UNII	G626T9S4PH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Acetic acid, 2,2?,2??-[[2-[(2E)-3-[4-(carboxymethoxy)phenyl]-1-oxo-2-propen-1-yl]-1,3,5-benzenetriyl]tris(oxy)]tris-

Preferred Name

English

2,2?,2??-[[2-[(2E)-3-[4-(Carboxymethoxy)phenyl]-1-oxo-2-propen-1-yl]-1,3,5-benzenetriyl]tris(oxy)]tris[acetic acid]

Systematic Name

English

Code System Code Type Description

FDA UNII

G626T9S4PH

Created by admin on Wed Apr 02 20:56:21 GMT 2025 , Edited by admin on Wed Apr 02 20:56:21 GMT 2025

PRIMARY

CAS

1395088-14-8

Created by admin on Wed Apr 02 20:56:21 GMT 2025 , Edited by admin on Wed Apr 02 20:56:21 GMT 2025

PRIMARY

Related Record Type Details


					26U8M6D3ZH

Tetrasodium 2,2?,2??-[[2-[(2E)-3-[4-(carboxymethoxy)phenyl]-1-oxo-2-propen-1-yl]-1,3,5-benzenetriyl]tris(oxy)]tris[acetate]

SALT/SOLVATE -> PARENT

Amount: