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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H6O4
Molecular Weight 214.1736
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzodipyrones

SMILES

O=C1OC2=CC3=C(OC(=O)C=C3)C=C2C=C1

InChI

InChIKey=ZXLJWZULPBXHSY-UHFFFAOYSA-N
InChI=1S/C12H6O4/c13-11-3-1-7-5-10-8(6-9(7)15-11)2-4-12(14)16-10/h1-6H

HIDE SMILES / InChI

Molecular Formula C12H6O4
Molecular Weight 214.1736
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 Sat Dec 16 12:42:54 UTC 2023
Edited
by admin
on Sat Dec 16 12:42:54 UTC 2023
Record UNII
8HR83QC3KG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzodipyrones
Common Name English
Benzo(1,2-b:4,5-b')dipyran-2,7-dione
Systematic Name English
Pyrano[2,3-g]chromene-2,7-dione
Systematic Name English
NSC-244430
Code English
Code System Code Type Description
CAS
54333-74-3
Created by admin on Sat Dec 16 12:42:54 UTC 2023 , Edited by admin on Sat Dec 16 12:42:54 UTC 2023
PRIMARY
FDA UNII
8HR83QC3KG
Created by admin on Sat Dec 16 12:42:54 UTC 2023 , Edited by admin on Sat Dec 16 12:42:54 UTC 2023
PRIMARY
NSC
244430
Created by admin on Sat Dec 16 12:42:54 UTC 2023 , Edited by admin on Sat Dec 16 12:42:54 UTC 2023
PRIMARY
PUBCHEM
99585
Created by admin on Sat Dec 16 12:42:54 UTC 2023 , Edited by admin on Sat Dec 16 12:42:54 UTC 2023
PRIMARY
EPA CompTox
DTXSID40202703
Created by admin on Sat Dec 16 12:42:54 UTC 2023 , Edited by admin on Sat Dec 16 12:42:54 UTC 2023
PRIMARY