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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H10O5
Molecular Weight 270.2369
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THUNBERGINOL A

SMILES

OC1=CC=C(C=C1O)C2=CC3=CC=CC(O)=C3C(=O)O2

InChI

InChIKey=WHZXJVJVGGWZQI-UHFFFAOYSA-N
InChI=1S/C15H10O5/c16-10-5-4-8(6-12(10)18)13-7-9-2-1-3-11(17)14(9)15(19)20-13/h1-7,16-18H

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-724383
Preferred Name English
THUNBERGINOL A
Common Name English
3-(3,4-Dihydroxyphenyl)-8-hydroxy-1H-2-benzopyran-1-one
Systematic Name English
1H-2-Benzopyran-1-one, 3-(3,4-dihydroxyphenyl)-8-hydroxy-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30163773
Created by admin on Wed Apr 02 08:41:24 GMT 2025 , Edited by admin on Wed Apr 02 08:41:24 GMT 2025
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WIKIPEDIA
Thunberginol A
Created by admin on Wed Apr 02 08:41:24 GMT 2025 , Edited by admin on Wed Apr 02 08:41:24 GMT 2025
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FDA UNII
WK8ZG6DZL6
Created by admin on Wed Apr 02 08:41:24 GMT 2025 , Edited by admin on Wed Apr 02 08:41:24 GMT 2025
PRIMARY
CAS
147666-80-6
Created by admin on Wed Apr 02 08:41:24 GMT 2025 , Edited by admin on Wed Apr 02 08:41:24 GMT 2025
PRIMARY
NSC
724383
Created by admin on Wed Apr 02 08:41:24 GMT 2025 , Edited by admin on Wed Apr 02 08:41:24 GMT 2025
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PUBCHEM
5321948
Created by admin on Wed Apr 02 08:41:24 GMT 2025 , Edited by admin on Wed Apr 02 08:41:24 GMT 2025
PRIMARY