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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H14
Molecular Weight 278.3466
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZO(C)CHRYSENE

SMILES

C1=CC2=C(C=C1)C3=C(C=C2)C4=C(C=CC5=C4C=CC=C5)C=C3

InChI

InChIKey=YZWGEMSQAMDWEM-UHFFFAOYSA-N
InChI=1S/C22H14/c1-3-7-18-15(5-1)11-14-21-20(18)13-12-17-10-9-16-6-2-4-8-19(16)22(17)21/h1-14H

HIDE SMILES / InChI

Molecular Formula C22H14
Molecular Weight 278.3466
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Glutathione conjugation of bay- and fjord-region diol epoxides of polycyclic aromatic hydrocarbons by glutathione transferases M1-1 and P1-1.
1997 Nov
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:15:02 GMT 2023
Edited
by admin
on Fri Dec 15 19:15:02 GMT 2023
Record UNII
0I8Z8V58Z4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZO(C)CHRYSENE
HSDB  
Systematic Name English
1,2,5,6-DIBENZPHENANTHRENE
Common Name English
5,6-BENZOCHRYSENE
Common Name English
BENZO(C)CHRYSENE [HSDB]
Common Name English
1,2:5,6-DIBENZOPHENANTHRENE
Common Name English
Code System Code Type Description
FDA UNII
0I8Z8V58Z4
Created by admin on Fri Dec 15 19:15:02 GMT 2023 , Edited by admin on Fri Dec 15 19:15:02 GMT 2023
PRIMARY
PUBCHEM
9135
Created by admin on Fri Dec 15 19:15:02 GMT 2023 , Edited by admin on Fri Dec 15 19:15:02 GMT 2023
PRIMARY
EPA CompTox
DTXSID3073894
Created by admin on Fri Dec 15 19:15:02 GMT 2023 , Edited by admin on Fri Dec 15 19:15:02 GMT 2023
PRIMARY
HSDB
4032
Created by admin on Fri Dec 15 19:15:02 GMT 2023 , Edited by admin on Fri Dec 15 19:15:02 GMT 2023
PRIMARY
MESH
C110144
Created by admin on Fri Dec 15 19:15:02 GMT 2023 , Edited by admin on Fri Dec 15 19:15:02 GMT 2023
PRIMARY
CAS
194-69-4
Created by admin on Fri Dec 15 19:15:02 GMT 2023 , Edited by admin on Fri Dec 15 19:15:02 GMT 2023
PRIMARY