6-HYDROXY-BEXAROTENE

Details

Stereochemistry	RACEMIC
Molecular Formula	C24H28O3
Molecular Weight	364.4773
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC2=C(C=C1C(=C)C3=CC=C(C=C3)C(O)=O)C(C)(C)CC(O)C2(C)C

InChI

InChIKey=WTWGVKDCAJSUBZ-UHFFFAOYSA-N

InChI=1S/C24H28O3/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/h7-12,21,25H,2,13H2,1,3-6H3,(H,26,27)

HIDE SMILES / InChI

Molecular Formula	C24H28O3
Molecular Weight	364.4773
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sun Dec 18 20:18:13 UTC 2022` Edited by `admin` on `Sun Dec 18 20:18:13 UTC 2022`
Record UNII	X522KMW8UA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6-HYDROXY-BEXAROTENE

Common Name

English

4-(1-(5,6,7,8-TETRAHYDRO-6-HYDROXY-3,5,5,8,8-PENTAMETHYL-2-NAPHTHALENYL)ETHENYL)BENZOIC ACID

Systematic Name

English

BENZOIC ACID, 4-(1-(5,6,7,8-TETRAHYDRO-6-HYDROXY-3,5,5,8,8-PENTAMETHYL-2-NAPHTHALENYL)ETHENYL)-

Systematic Name

English

Code System Code Type Description

CAS

368451-07-4

Created by admin on Sun Dec 18 20:18:13 UTC 2022 , Edited by admin on Sun Dec 18 20:18:13 UTC 2022

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FDA UNII

X522KMW8UA

Created by admin on Sun Dec 18 20:18:13 UTC 2022 , Edited by admin on Sun Dec 18 20:18:13 UTC 2022

PRIMARY

PUBCHEM

10067357

Created by admin on Sun Dec 18 20:18:13 UTC 2022 , Edited by admin on Sun Dec 18 20:18:13 UTC 2022

PRIMARY

EPA CompTox

DTXSID40435130

Created by admin on Sun Dec 18 20:18:13 UTC 2022 , Edited by admin on Sun Dec 18 20:18:13 UTC 2022

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Related Record Type Details


					A61RXM4375

BEXAROTENE

PARENT -> METABOLITE

Interaction Type:

MAJOR

Qualification:

PLASMA