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Details

Stereochemistry ACHIRAL
Molecular Formula C20H16
Molecular Weight 256.341
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7,8,9,10-TETRAHYDROBENZO(A)PYRENE

SMILES

C1CCC2=C3C=CC4=C5C(C=CC(C=C2C1)=C35)=CC=C4

InChI

InChIKey=CTXOSVBTVTWJBN-UHFFFAOYSA-N
InChI=1S/C20H16/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h3,5-6,8-12H,1-2,4,7H2

HIDE SMILES / InChI

Molecular Formula C20H16
Molecular Weight 256.341
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
3'-H-phosphonate synthesis of chiral benzo[a]pyrene diol epoxide adducts at N(2) of deoxyguanosine in oligonucleotides.
2007-02
Probing the interaction of benzo[a]pyrene adducts and metabolites with monoclonal antibodies using fluorescence line-narrowing spectroscopy.
2004-02-01
A single site-specific trans-opened 7,8,9,10-tetrahydrobenzo[a]pyrene 7,8-diol 9,10-epoxide N2-deoxyguanosine adduct induces mutations at multiple sites in DNA.
2003-04-25
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:37:21 GMT 2025
Edited
by admin
on Mon Mar 31 18:37:21 GMT 2025
Record UNII
X6YIN953QD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7,8,9,10-TETRAHYDROBENZO(A)PYRENE
Systematic Name English
7,8,9,10-TETRAHYDROBENZ(A)PYRENE
Preferred Name English
BENZO(A)PYRENE, 7,8,9,10-TETRAHYDRO-
Systematic Name English
Code System Code Type Description
FDA UNII
X6YIN953QD
Created by admin on Mon Mar 31 18:37:21 GMT 2025 , Edited by admin on Mon Mar 31 18:37:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID201300493
Created by admin on Mon Mar 31 18:37:21 GMT 2025 , Edited by admin on Mon Mar 31 18:37:21 GMT 2025
PRIMARY
PUBCHEM
620668
Created by admin on Mon Mar 31 18:37:21 GMT 2025 , Edited by admin on Mon Mar 31 18:37:21 GMT 2025
PRIMARY
CAS
17750-93-5
Created by admin on Mon Mar 31 18:37:21 GMT 2025 , Edited by admin on Mon Mar 31 18:37:21 GMT 2025
PRIMARY