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

Details

Stereochemistry ACHIRAL
Molecular Formula C27H28O6
Molecular Weight 448.5076
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOPOMIFERIN DIMETHYLETHER

SMILES

COC1=CC=C(C=C1OC)C2=COC3=C(C2=O)C4=C(CCC(C)(C)O4)C5=C3C=CC(C)(C)O5

InChI

InChIKey=MIELJMQQHAVDFQ-UHFFFAOYSA-N
InChI=1S/C27H28O6/c1-26(2)11-9-16-23(32-26)17-10-12-27(3,4)33-25(17)21-22(28)18(14-31-24(16)21)15-7-8-19(29-5)20(13-15)30-6/h7-9,11,13-14H,10,12H2,1-6H3

HIDE SMILES / InChI

Molecular Formula C27H28O6
Molecular Weight 448.5076
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 Tue Apr 01 20:14:50 GMT 2025
Edited
by admin
on Tue Apr 01 20:14:50 GMT 2025
Record UNII
OGH0OO9DM5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-21572
Preferred Name English
ISOPOMIFERIN DIMETHYLETHER
Common Name English
2H,6H,12H-BENZO(1,2-B:3,4-B':5,6-B'')TRIPYRAN-12-ONE, 11-(3,4-DIMETHOXYPHENYL)-3,4-DIHYDRO-2,2,6,6-TETRAMETHYL-
Systematic Name English
Code System Code Type Description
CAS
7147-94-6
Created by admin on Tue Apr 01 20:14:50 GMT 2025 , Edited by admin on Tue Apr 01 20:14:50 GMT 2025
PRIMARY
NSC
21572
Created by admin on Tue Apr 01 20:14:50 GMT 2025 , Edited by admin on Tue Apr 01 20:14:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID30221685
Created by admin on Tue Apr 01 20:14:50 GMT 2025 , Edited by admin on Tue Apr 01 20:14:50 GMT 2025
PRIMARY
FDA UNII
OGH0OO9DM5
Created by admin on Tue Apr 01 20:14:50 GMT 2025 , Edited by admin on Tue Apr 01 20:14:50 GMT 2025
PRIMARY
PUBCHEM
228565
Created by admin on Tue Apr 01 20:14:50 GMT 2025 , Edited by admin on Tue Apr 01 20:14:50 GMT 2025
PRIMARY