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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H14O4
Molecular Weight 270.28
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4,4'-DIHYDROXY-2'-METHOXYCHALCONE

SMILES

COC1=C(C=CC(O)=C1)C(=O)\C=C\C2=CC=C(O)C=C2

InChI

InChIKey=PACBGANPVNHGNP-RUDMXATFSA-N
InChI=1S/C16H14O4/c1-20-16-10-13(18)7-8-14(16)15(19)9-4-11-2-5-12(17)6-3-11/h2-10,17-18H,1H3/b9-4+

HIDE SMILES / InChI

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: Q9IGQ6
Gene ID: NA
Gene Symbol: NA
Target Organism: Influenza A virus (strain A/Brevig Mission/1/1918 H1N1) (Influenza A|||virus (strain A/South Carolina/1/1918 H1N1))
24.3 µM [IC50]
Name Type Language
(2E)-1-(4-HYDROXY-2-METHOXYPHENYL)-3-(4-HYDROXYPHENYL)-2-PROPEN-1-ONE
Preferred Name English
4,4'-DIHYDROXY-2'-METHOXYCHALCONE
Systematic Name English
2'-METHOXYISOLIQUIRITIGENIN
Systematic Name English
2'-O-METHYLISOLIQUIRITIGENIN
Systematic Name English
2-PROPEN-1-ONE, 1-(4-HYDROXY-2-METHOXYPHENYL)-3-(4-HYDROXYPHENYL)-, (2E)-
Systematic Name English
3-DEOXYSAPPANCHALCONE
Systematic Name English
Code System Code Type Description
CAS
112408-67-0
Created by admin on Tue Apr 01 16:26:00 GMT 2025 , Edited by admin on Tue Apr 01 16:26:00 GMT 2025
PRIMARY
EPA CompTox
DTXSID30649062
Created by admin on Tue Apr 01 16:26:00 GMT 2025 , Edited by admin on Tue Apr 01 16:26:00 GMT 2025
PRIMARY
FDA UNII
LHE9JFQ1U8
Created by admin on Tue Apr 01 16:26:00 GMT 2025 , Edited by admin on Tue Apr 01 16:26:00 GMT 2025
PRIMARY
CHEBI
519567
Created by admin on Tue Apr 01 16:26:00 GMT 2025 , Edited by admin on Tue Apr 01 16:26:00 GMT 2025
PRIMARY
CAS
51828-10-5
Created by admin on Tue Apr 01 16:26:00 GMT 2025 , Edited by admin on Tue Apr 01 16:26:00 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
5319688
Created by admin on Tue Apr 01 16:26:00 GMT 2025 , Edited by admin on Tue Apr 01 16:26:00 GMT 2025
PRIMARY