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 1
Charge 0

SHOW SMILES / InChI
Structure of THUNBERGINOL F

SMILES

OC1=CC=C(\C=C2/OC(=O)C3=C(O)C=CC=C23)C=C1O

InChI

InChIKey=CFXQRFYFWXTZOJ-QPEQYQDCSA-N
InChI=1S/C15H10O5/c16-10-5-4-8(6-12(10)18)7-13-9-2-1-3-11(17)14(9)15(19)20-13/h1-7,16-18H/b13-7-

HIDE SMILES / InChI

Molecular Formula C15H10O5
Molecular Weight 270.2369
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 Wed Apr 02 11:07:48 GMT 2025
Edited
by admin
on Wed Apr 02 11:07:48 GMT 2025
Record UNII
2PA68RH5E6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(3Z)-3-((3,4-DIHYDROXYPHENYL)METHYLENE)-7-HYDROXY-1(3H)-ISOBENZOFURANONE
Preferred Name English
THUNBERGINOL F
Common Name English
1(3H)-ISOBENZOFURANONE, 3-((3,4-DIHYDROXYPHENYL)METHYLENE)-7-HYDROXY-, (3Z)-
Systematic Name English
1(3H)-ISOBENZOFURANONE, 3-((3,4-DIHYDROXYPHENYL)METHYLENE)-7-HYDROXY-, (Z)-
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Thunberginol F
Created by admin on Wed Apr 02 11:07:48 GMT 2025 , Edited by admin on Wed Apr 02 11:07:48 GMT 2025
PRIMARY
PUBCHEM
6439493
Created by admin on Wed Apr 02 11:07:48 GMT 2025 , Edited by admin on Wed Apr 02 11:07:48 GMT 2025
PRIMARY
CAS
147666-82-8
Created by admin on Wed Apr 02 11:07:48 GMT 2025 , Edited by admin on Wed Apr 02 11:07:48 GMT 2025
PRIMARY
FDA UNII
2PA68RH5E6
Created by admin on Wed Apr 02 11:07:48 GMT 2025 , Edited by admin on Wed Apr 02 11:07:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID501029763
Created by admin on Wed Apr 02 11:07:48 GMT 2025 , Edited by admin on Wed Apr 02 11:07:48 GMT 2025
PRIMARY