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Details

Stereochemistry ACHIRAL
Molecular Formula C21H22O9
Molecular Weight 418.394
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GARDENIN A

SMILES

COC1=CC(=CC(OC)=C1OC)C2=CC(=O)C3=C(O)C(OC)=C(OC)C(OC)=C3O2

InChI

InChIKey=MQBFFYQCZCKSBX-UHFFFAOYSA-N
InChI=1S/C21H22O9/c1-24-13-7-10(8-14(25-2)17(13)26-3)12-9-11(22)15-16(23)19(27-4)21(29-6)20(28-5)18(15)30-12/h7-9,23H,1-6H3

HIDE SMILES / InChI

Molecular Formula C21H22O9
Molecular Weight 418.394
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006-11
Steroid hormone activity of flavonoids and related compounds.
2000-07
Inhibition of HIV-1 integrase by flavones, caffeic acid phenethyl ester (CAPE) and related compounds.
1994-08-03
Flavones are inhibitors of HIV-1 proteinase.
1992-10-30
Differential inhibitory effects of various flavonoids on the activities of reverse transcriptase and cellular DNA and RNA polymerases.
1990-07-05
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:02:40 GMT 2025
Edited
by admin
on Mon Mar 31 18:02:40 GMT 2025
Record UNII
24J0W87Z43
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GARDENIN A
MI  
Common Name English
NSC-94889
Preferred Name English
5-HYDROXY-3',4',5',6,7,8-HEXAMETHOXYFLAVONE
Systematic Name English
4H-1-BENZOPYRAN-4-ONE, 5-HYDROXY-6,7,8-TRIMETHOXY-2-(3,4,5-TRIMETHOXYPHENYL)-
Systematic Name English
GARDENIN
Common Name English
5-HYDROXY-6,7,8,3',4',5'-HEXAMETHOXYFLAVONE
Systematic Name English
GARDENIN A [MI]
Common Name English
Code System Code Type Description
FDA UNII
24J0W87Z43
Created by admin on Mon Mar 31 18:02:40 GMT 2025 , Edited by admin on Mon Mar 31 18:02:40 GMT 2025
PRIMARY
PUBCHEM
261859
Created by admin on Mon Mar 31 18:02:40 GMT 2025 , Edited by admin on Mon Mar 31 18:02:40 GMT 2025
PRIMARY
CAS
21187-73-5
Created by admin on Mon Mar 31 18:02:40 GMT 2025 , Edited by admin on Mon Mar 31 18:02:40 GMT 2025
PRIMARY
EPA CompTox
DTXSID30175417
Created by admin on Mon Mar 31 18:02:40 GMT 2025 , Edited by admin on Mon Mar 31 18:02:40 GMT 2025
PRIMARY
MERCK INDEX
m5669
Created by admin on Mon Mar 31 18:02:40 GMT 2025 , Edited by admin on Mon Mar 31 18:02:40 GMT 2025
PRIMARY Merck Index
NSC
94889
Created by admin on Mon Mar 31 18:02:40 GMT 2025 , Edited by admin on Mon Mar 31 18:02:40 GMT 2025
PRIMARY