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Details

Stereochemistry RACEMIC
Molecular Formula C22H14O
Molecular Weight 294.346
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1A,13C-DIHYDRO-BENZO(11,12)CHRYSENO(5,6-B)OXIRENE

SMILES

O1[C@H]2[C@@H]1C3=C(C4=C2C=CC=C4)C5=C(C=CC=C5)C6=C3C=CC=C6

InChI

InChIKey=AZMBGVSQXIPCMQ-YADHBBJMSA-N
InChI=1S/C22H14O/c1-3-9-15-13(7-1)14-8-2-4-10-16(14)20-19(15)17-11-5-6-12-18(17)21-22(20)23-21/h1-12,21-22H/t21-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H14O
Molecular Weight 294.346
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:52:26 GMT 2025
Edited
by admin
on Mon Mar 31 21:52:26 GMT 2025
Record UNII
DIK37885GQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZO(11,12)CHRYSENO(5,6-B)OXIRENE, 1A,13C-DIHYDRO-
Preferred Name English
1A,13C-DIHYDRO-BENZO(11,12)CHRYSENO(5,6-B)OXIRENE
Common Name English
Code System Code Type Description
FDA UNII
DIK37885GQ
Created by admin on Mon Mar 31 21:52:26 GMT 2025 , Edited by admin on Mon Mar 31 21:52:26 GMT 2025
PRIMARY
CAS
84850-16-8
Created by admin on Mon Mar 31 21:52:26 GMT 2025 , Edited by admin on Mon Mar 31 21:52:26 GMT 2025
PRIMARY
EPA CompTox
DTXSID30233905
Created by admin on Mon Mar 31 21:52:26 GMT 2025 , Edited by admin on Mon Mar 31 21:52:26 GMT 2025
PRIMARY
PUBCHEM
13432387
Created by admin on Mon Mar 31 21:52:26 GMT 2025 , Edited by admin on Mon Mar 31 21:52:26 GMT 2025
PRIMARY