U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C18H14O9
Molecular Weight 374.2984
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIPHLORETHOL B

SMILES

OC1=CC(OC2=C(O)C=C(O)C=C2OC3=C(O)C=C(O)C=C3O)=CC(O)=C1

InChI

InChIKey=OXFVHFABBAINFL-UHFFFAOYSA-N
InChI=1S/C18H14O9/c19-8-1-9(20)3-12(2-8)26-18-15(25)6-11(22)7-16(18)27-17-13(23)4-10(21)5-14(17)24/h1-7,19-25H

HIDE SMILES / InChI

Molecular Formula C18H14O9
Molecular Weight 374.2984
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 16:33:20 GMT 2023
Edited
by admin
on Sat Dec 16 16:33:20 GMT 2023
Record UNII
7E4LT54X4D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRIPHLORETHOL B
Common Name English
2-(2-(3,5-DIHYDROXYPHENOXY)-3,5-DIHYDROXYPHENOXY)-1,3,5-BENZENETRIOL
Systematic Name English
2-(2-(3,5-BIS(OXIDANYL)PHENOXY)-3,5-BIS(OXIDANYL)PHENOXY)BENZENE-1,3,5-TRIOL
Systematic Name English
1,3,5-BENZENETRIOL, 2-(2-(3,5-DIHYDROXYPHENOXY)-3,5-DIHYDROXYPHENOXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
21626545
Created by admin on Sat Dec 16 16:33:20 GMT 2023 , Edited by admin on Sat Dec 16 16:33:20 GMT 2023
PRIMARY
CAS
79005-83-7
Created by admin on Sat Dec 16 16:33:20 GMT 2023 , Edited by admin on Sat Dec 16 16:33:20 GMT 2023
PRIMARY
FDA UNII
7E4LT54X4D
Created by admin on Sat Dec 16 16:33:20 GMT 2023 , Edited by admin on Sat Dec 16 16:33:20 GMT 2023
PRIMARY