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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H12O7
Molecular Weight 316.2623
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3',4',5,7-TETRAHYDROXY-8-METHOXYISOFLAVONE

SMILES

COC1=C2OC=C(C(=O)C2=C(O)C=C1O)C3=CC=C(O)C(O)=C3

InChI

InChIKey=LOPIYUZMSJFIQA-UHFFFAOYSA-N
InChI=1S/C16H12O7/c1-22-15-12(20)5-11(19)13-14(21)8(6-23-16(13)15)7-2-3-9(17)10(18)4-7/h2-6,17-20H,1H3

HIDE SMILES / InChI

Molecular Formula C16H12O7
Molecular Weight 316.2623
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:45:44 GMT 2023
Edited
by admin
on Fri Dec 15 19:45:44 GMT 2023
Record UNII
790ION7S08
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3',4',5,7-TETRAHYDROXY-8-METHOXYISOFLAVONE
Common Name English
4H-1-BENZOPYRAN-4-ONE, 3-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-8-METHOXY-
Systematic Name English
3-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-8-METHOXY-4H-1-BENZOPYRAN-4-ONE
Systematic Name English
5,7-DIHYDROXY-3-(3,4-DIHYDROXYPHENYL)-8-METHOXY-4H-1-BENZOPYRAN-4-ONE
Systematic Name English
Code System Code Type Description
CAS
58262-89-8
Created by admin on Fri Dec 15 19:45:44 GMT 2023 , Edited by admin on Fri Dec 15 19:45:44 GMT 2023
PRIMARY
FDA UNII
790ION7S08
Created by admin on Fri Dec 15 19:45:44 GMT 2023 , Edited by admin on Fri Dec 15 19:45:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID30206992
Created by admin on Fri Dec 15 19:45:44 GMT 2023 , Edited by admin on Fri Dec 15 19:45:44 GMT 2023
PRIMARY
PUBCHEM
5493449
Created by admin on Fri Dec 15 19:45:44 GMT 2023 , Edited by admin on Fri Dec 15 19:45:44 GMT 2023
PRIMARY