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Details

Stereochemistry ACHIRAL
Molecular Formula C24H26O3
Molecular Weight 362.4614
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-OXO-BEXAROTENE

SMILES

CC1=C(C=C2C(=C1)C(C)(C)C(=O)CC2(C)C)C(=C)C3=CC=C(C=C3)C(O)=O

InChI

InChIKey=ZODXGLWZRPTBIM-UHFFFAOYSA-N
InChI=1S/C24H26O3/c1-14-11-20-19(23(3,4)13-21(25)24(20,5)6)12-18(14)15(2)16-7-9-17(10-8-16)22(26)27/h7-12H,2,13H2,1,3-6H3,(H,26,27)

HIDE SMILES / InChI

Molecular Formula C24H26O3
Molecular Weight 362.4614
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 08:45:21 GMT 2025
Edited
by admin
on Wed Apr 02 08:45:21 GMT 2025
Record UNII
915M2UFU28
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(1-(5,6,7,8-TETRAHYDRO-3,5,5,8,8-PENTAMETHYL-6-OXO-2-NAPHTHALENYL)ETHENYL)BENZOIC ACID
Preferred Name English
6-OXO-BEXAROTENE
Common Name English
BENZOIC ACID, 4-(1-(5,6,7,8-TETRAHYDRO-3,5,5,8,8-PENTAMETHYL-6-OXO-2-NAPHTHALENYL)ETHENYL)-
Systematic Name English
Code System Code Type Description
CAS
368451-13-2
Created by admin on Wed Apr 02 08:45:21 GMT 2025 , Edited by admin on Wed Apr 02 08:45:21 GMT 2025
PRIMARY
FDA UNII
915M2UFU28
Created by admin on Wed Apr 02 08:45:21 GMT 2025 , Edited by admin on Wed Apr 02 08:45:21 GMT 2025
PRIMARY
PUBCHEM
101142042
Created by admin on Wed Apr 02 08:45:21 GMT 2025 , Edited by admin on Wed Apr 02 08:45:21 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
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