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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H16O3
Molecular Weight 352.382
Optical Activity ( + )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANTI-DBPDE, (+)-

SMILES

O[C@H]1[C@H]2O[C@H]2C3=C(C=C4C=CC5=CC=CC6=C5C4=C3C7=CC=CC=C67)[C@@H]1O

InChI

InChIKey=CJAMAUFDXDSQLU-UARRHKHWSA-N
InChI=1S/C24H16O3/c25-21-16-10-12-9-8-11-4-3-7-14-13-5-1-2-6-15(13)19(18(12)17(11)14)20(16)23-24(27-23)22(21)26/h1-10,21-26H/t21-,22+,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H16O3
Molecular Weight 352.382
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:00:37 GMT 2023
Edited
by admin
on Sat Dec 16 10:00:37 GMT 2023
Record UNII
5FTF7CEX6S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANTI-DBPDE, (+)-
Common Name English
(+)-ANTI-DBPDE
Common Name English
ANTI-DIBENZO(A,L)PYRENE-11R,12S-DIHYDRODIOL 13S,14R-EPOXIDE, (+)-
Systematic Name English
DIBENZO(5,6:10,11)CHRYSENO(3,4-B)OXIRENE-11,12-DIOL, 11,12,12A,13A-TETRAHYDRO-, (11S,12R,12AR,13AS)-
Systematic Name English
(11S,12R,12AR,13AS)-11,12,12A,13A-TETRAHYDRODIBENZO(5,6:10,11)CHRYSENO(3,4-B)OXIRENE-11,12-DIOL
Common Name English
Code System Code Type Description
FDA UNII
5FTF7CEX6S
Created by admin on Sat Dec 16 10:00:37 GMT 2023 , Edited by admin on Sat Dec 16 10:00:37 GMT 2023
PRIMARY
CAS
191151-57-2
Created by admin on Sat Dec 16 10:00:37 GMT 2023 , Edited by admin on Sat Dec 16 10:00:37 GMT 2023
PRIMARY
PUBCHEM
91826848
Created by admin on Sat Dec 16 10:00:37 GMT 2023 , Edited by admin on Sat Dec 16 10:00:37 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER
RACEMATE -> ENANTIOMER