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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H10O2
Molecular Weight 282.2922
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZO(A)PYRENE-3,6-DIONE

SMILES

O=C1C=CC2=C3C1=CC=C4C(=O)C5=C(C=CC=C5)C(C=C2)=C34

InChI

InChIKey=MYRYNZSMCVOJHZ-UHFFFAOYSA-N
InChI=1S/C20H10O2/c21-17-10-6-11-5-7-13-12-3-1-2-4-14(12)20(22)16-9-8-15(17)18(11)19(13)16/h1-10H

HIDE SMILES / InChI

Approval Year

Name Type Language
BENZO(A)PYRENE-3,6-DIONE
Systematic Name English
3,6-BENZO(A)PYRENEQUINONE
Preferred Name English
BENZO(A)PYRENE-3,6-QUINONE
Systematic Name English
Code System Code Type Description
PUBCHEM
18301
Created by admin on Mon Mar 31 18:47:15 GMT 2025 , Edited by admin on Mon Mar 31 18:47:15 GMT 2025
PRIMARY
FDA UNII
CT61YDG18C
Created by admin on Mon Mar 31 18:47:15 GMT 2025 , Edited by admin on Mon Mar 31 18:47:15 GMT 2025
PRIMARY
EPA CompTox
DTXSID40952918
Created by admin on Mon Mar 31 18:47:15 GMT 2025 , Edited by admin on Mon Mar 31 18:47:15 GMT 2025
PRIMARY
CAS
3067-14-9
Created by admin on Mon Mar 31 18:47:15 GMT 2025 , Edited by admin on Mon Mar 31 18:47:15 GMT 2025
PRIMARY