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Details

Stereochemistry ACHIRAL
Molecular Formula C16H8O2
Molecular Weight 232.2335
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,8-PYRENEDIONE

SMILES

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

InChI

InChIKey=XETOQIJGUBNXLQ-UHFFFAOYSA-N
InChI=1S/C16H8O2/c17-13-7-3-9-1-2-10-4-8-14(18)12-6-5-11(13)15(9)16(10)12/h1-8H

HIDE SMILES / InChI

Molecular Formula C16H8O2
Molecular Weight 232.2335
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Comparison of the urinary excretion time courses of pyrene-1,6-dione, pyrene-1,8-dione and 1-hydroxypyrene in rats intravenously exposed to pyrene.
2006-09-13
1-Methoxypyrene and 1,6-dimethoxypyrene: two novel metabolites in fungal metabolism of polycyclic aromatic hydrocarbons.
1997-05
Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:55:28 GMT 2025
Edited
by admin
on Mon Mar 31 18:55:28 GMT 2025
Record UNII
N55G3TLC7D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,10-PYRENEDIONE
Preferred Name English
1,8-PYRENEDIONE
Systematic Name English
3,6-PYRENEDIONE
Systematic Name English
3,6-PYRENEQUINONE
Systematic Name English
3,10-PYRENEQUINONE
Common Name English
1,8-PYRENEQUINONE
Systematic Name English
Code System Code Type Description
FDA UNII
N55G3TLC7D
Created by admin on Mon Mar 31 18:55:28 GMT 2025 , Edited by admin on Mon Mar 31 18:55:28 GMT 2025
PRIMARY
ECHA (EC/EINECS)
218-966-9
Created by admin on Mon Mar 31 18:55:28 GMT 2025 , Edited by admin on Mon Mar 31 18:55:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID8062317
Created by admin on Mon Mar 31 18:55:28 GMT 2025 , Edited by admin on Mon Mar 31 18:55:28 GMT 2025
PRIMARY
MESH
C031175
Created by admin on Mon Mar 31 18:55:28 GMT 2025 , Edited by admin on Mon Mar 31 18:55:28 GMT 2025
PRIMARY
CAS
2304-85-0
Created by admin on Mon Mar 31 18:55:28 GMT 2025 , Edited by admin on Mon Mar 31 18:55:28 GMT 2025
PRIMARY
PUBCHEM
16820
Created by admin on Mon Mar 31 18:55:28 GMT 2025 , Edited by admin on Mon Mar 31 18:55:28 GMT 2025
PRIMARY