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Details

Stereochemistry ACHIRAL
Molecular Formula C35H30N2O7S2
Molecular Weight 654.752
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Acid Red 289 free acid

SMILES

CC1=CC=CC(C)=C1NC2=CC3=[O+]C4=CC(NC5=C(C)C=CC(=C5C)S(O)(=O)=O)=CC=C4C(C6=CC=CC=C6S([O-])(=O)=O)=C3C=C2

InChI

InChIKey=WUWBSWJCYRYUIC-UHFFFAOYSA-N
InChI=1S/C35H30N2O7S2/c1-20-8-7-9-21(2)34(20)36-24-13-15-26-29(18-24)44-30-19-25(37-35-22(3)12-17-31(23(35)4)45(38,39)40)14-16-27(30)33(26)28-10-5-6-11-32(28)46(41,42)43/h5-19,36-37H,1-4H3,(H-,38,39,40,41,42,43)

HIDE SMILES / InChI

Molecular Formula C35H30N2O7S2
Molecular Weight 654.752
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 Wed Apr 02 19:42:20 GMT 2025
Edited
by admin
on Wed Apr 02 19:42:20 GMT 2025
Record UNII
7JKD3UM3GP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Acid Red 289 free acid
Common Name English
Xanthylium, 3-[(2,6-dimethylphenyl)amino]-6-[(2,6-dimethyl-3-sulfophenyl)amino]-9-(2-sulfophenyl)-, inner salt
Preferred Name English
Code System Code Type Description
FDA UNII
7JKD3UM3GP
Created by admin on Wed Apr 02 19:42:20 GMT 2025 , Edited by admin on Wed Apr 02 19:42:20 GMT 2025
PRIMARY
CAS
1522136-70-4
Created by admin on Wed Apr 02 19:42:20 GMT 2025 , Edited by admin on Wed Apr 02 19:42:20 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT