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Details

Stereochemistry ACHIRAL
Molecular Formula C15H8Br2O6
Molecular Weight 444.028
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3',5'-DIBROMO-2',4,4',6-TETRAHYDROXYAURONE

SMILES

OC1=CC2=C(C(=O)\C(O2)=C\C3=CC(Br)=C(O)C(Br)=C3O)C(O)=C1

InChI

InChIKey=BRPKBUNFOZFULQ-SGAXSIHGSA-N
InChI=1S/C15H8Br2O6/c16-7-1-5(13(20)12(17)14(7)21)2-10-15(22)11-8(19)3-6(18)4-9(11)23-10/h1-4,18-21H/b10-2-

HIDE SMILES / InChI

Molecular Formula C15H8Br2O6
Molecular Weight 444.028
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 Tue Apr 01 16:33:55 GMT 2025
Edited
by admin
on Tue Apr 01 16:33:55 GMT 2025
Record UNII
QT9515X0WW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EMD-47021
Preferred Name English
3',5'-DIBROMO-2',4,4',6-TETRAHYDROXYAURONE
Common Name English
3(2H)-BENZOFURANONE, 2-((3,5-DIBROMO-2,4-DIHYDROXYPHENYL)METHYLENE)-4,6-DIHYDROXY-, (Z)-
Systematic Name English
3',5'-DIBROMO-2',4,4',6'-TETRAHYDROXY AURONE
Common Name English
2-((3,5-DIBROMO-2,4-DIHYDROXYPHENYL)METHYLENE)-4,6-DIHYDROXY-3(2H)-BENZOFURANONE
Systematic Name English
Code System Code Type Description
FDA UNII
QT9515X0WW
Created by admin on Tue Apr 01 16:33:55 GMT 2025 , Edited by admin on Tue Apr 01 16:33:55 GMT 2025
PRIMARY
PUBCHEM
5288217
Created by admin on Tue Apr 01 16:33:55 GMT 2025 , Edited by admin on Tue Apr 01 16:33:55 GMT 2025
PRIMARY
CAS
126985-05-5
Created by admin on Tue Apr 01 16:33:55 GMT 2025 , Edited by admin on Tue Apr 01 16:33:55 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
CAS
105098-41-7
Created by admin on Tue Apr 01 16:33:55 GMT 2025 , Edited by admin on Tue Apr 01 16:33:55 GMT 2025
PRIMARY
DRUG BANK
DB07775
Created by admin on Tue Apr 01 16:33:55 GMT 2025 , Edited by admin on Tue Apr 01 16:33:55 GMT 2025
PRIMARY