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Details

Stereochemistry RACEMIC
Molecular Formula C21H15NO2
Molecular Weight 313.3493
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,6-DIHYDRODIBENZ(A,J)ACRIDINE-5,6-DIOL, TRANS-(±)-

SMILES

O[C@@H]1[C@@H](O)C2=C(C=C3C(C=CC4=C3C=CC=C4)=N2)C5=CC=CC=C15

InChI

InChIKey=JKYQNBZDRDQRTD-SFTDATJTSA-N
InChI=1S/C21H15NO2/c23-20-15-8-4-3-7-14(15)17-11-16-13-6-2-1-5-12(13)9-10-18(16)22-19(17)21(20)24/h1-11,20-21,23-24H/t20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H15NO2
Molecular Weight 313.3493
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 22:23:13 GMT 2025
Edited
by admin
on Mon Mar 31 22:23:13 GMT 2025
Record UNII
Z028N4D2Q5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5,6-DIHYDRODIBENZ(A,J)ACRIDINE-5,6-DIOL, TRANS-(±)-
Systematic Name English
DIBENZ(A,J)ACRIDINE-5,6-DIOL, 5,6-DIHYDRO-, TRANS-
Preferred Name English
TRANS-DIBENZ(A,J)ACRIDINE-5,6-DIHYDRODIOL
Systematic Name English
DIBENZ(A,J)ACRIDINE-5,6-DIOL, 5,6-DIHYDRO-, TRANS-(±)-
Systematic Name English
TRANS-5,6-DIHYDRO-5,6-DIHYDROXYDIBENZ(A,J)ACRIDINE
Systematic Name English
Code System Code Type Description
CAS
105467-64-9
Created by admin on Mon Mar 31 22:23:13 GMT 2025 , Edited by admin on Mon Mar 31 22:23:13 GMT 2025
PRIMARY
PUBCHEM
146659
Created by admin on Mon Mar 31 22:23:13 GMT 2025 , Edited by admin on Mon Mar 31 22:23:13 GMT 2025
PRIMARY
EPA CompTox
DTXSID00909549
Created by admin on Mon Mar 31 22:23:13 GMT 2025 , Edited by admin on Mon Mar 31 22:23:13 GMT 2025
PRIMARY
CAS
117066-35-0
Created by admin on Mon Mar 31 22:23:13 GMT 2025 , Edited by admin on Mon Mar 31 22:23:13 GMT 2025
SUPERSEDED
FDA UNII
Z028N4D2Q5
Created by admin on Mon Mar 31 22:23:13 GMT 2025 , Edited by admin on Mon Mar 31 22:23:13 GMT 2025
PRIMARY