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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=C(C1)C=C3C=CC4=CC=CC5=CC=C2C3=C45

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
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 Apr 25
Probing the interaction of benzo[a]pyrene adducts and metabolites with monoclonal antibodies using fluorescence line-narrowing spectroscopy.
2004 Feb 1
3'-H-phosphonate synthesis of chiral benzo[a]pyrene diol epoxide adducts at N(2) of deoxyguanosine in oligonucleotides.
2007 Feb
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:52:34 GMT 2023
Edited
by admin
on Fri Dec 15 16:52:34 GMT 2023
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
Systematic 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 Fri Dec 15 16:52:34 GMT 2023 , Edited by admin on Fri Dec 15 16:52:34 GMT 2023
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EPA CompTox
DTXSID201300493
Created by admin on Fri Dec 15 16:52:34 GMT 2023 , Edited by admin on Fri Dec 15 16:52:34 GMT 2023
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PUBCHEM
620668
Created by admin on Fri Dec 15 16:52:34 GMT 2023 , Edited by admin on Fri Dec 15 16:52:34 GMT 2023
PRIMARY
CAS
17750-93-5
Created by admin on Fri Dec 15 16:52:34 GMT 2023 , Edited by admin on Fri Dec 15 16:52:34 GMT 2023
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