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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H24O7
Molecular Weight 388.4111
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BIS(3,4,5-TRIMETHOXYPHENYL)PROP-2-EN-1-ONE, (E)-

SMILES

COC1=CC(\C=C\C(=O)C2=CC(OC)=C(OC)C(OC)=C2)=CC(OC)=C1OC

InChI

InChIKey=WOJJYHZSZSSQJL-BQYQJAHWSA-N
InChI=1S/C21H24O7/c1-23-16-9-13(10-17(24-2)20(16)27-5)7-8-15(22)14-11-18(25-3)21(28-6)19(12-14)26-4/h7-12H,1-6H3/b8-7+

HIDE SMILES / InChI

Molecular Formula C21H24O7
Molecular Weight 388.4111
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 Mon Mar 31 22:57:35 GMT 2025
Edited
by admin
on Mon Mar 31 22:57:35 GMT 2025
Record UNII
RYU875G50O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BIS(3,4,5-TRIMETHOXYPHENYL)PROP-2-EN-1-ONE, (E)-
Systematic Name English
(E)-1,3-BIS(3,4,5-TRIMETHOXYPHENYL)PROP-2-EN-1-ONE
Preferred Name English
3',4',5',3,4,5-HEXAMETHOXY-CHALCONE
Systematic Name English
Code System Code Type Description
CAS
130768-87-5
Created by admin on Mon Mar 31 22:57:35 GMT 2025 , Edited by admin on Mon Mar 31 22:57:35 GMT 2025
PRIMARY
PUBCHEM
6145900
Created by admin on Mon Mar 31 22:57:35 GMT 2025 , Edited by admin on Mon Mar 31 22:57:35 GMT 2025
PRIMARY
FDA UNII
RYU875G50O
Created by admin on Mon Mar 31 22:57:35 GMT 2025 , Edited by admin on Mon Mar 31 22:57:35 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY