DORETINEL

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C24H30O2
Molecular Weight	350.4938
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of DORETINEL

Structure Search

SMILES

C\C(=C/C1=CC=C(CO)C=C1)C2=CC3=C(C=C2)C(C)(C)CC(O)C3(C)C

InChI

InChIKey=AILNZJCWRAWPSD-FOWTUZBSSA-N

InChI=1S/C24H30O2/c1-16(12-17-6-8-18(15-25)9-7-17)19-10-11-20-21(13-19)24(4,5)22(26)14-23(20,2)3/h6-13,22,25-26H,14-15H2,1-5H3/b16-12+

HIDE SMILES / InChI

Molecular Formula	C24H30O2
Molecular Weight	350.4938
Charge	0
Count

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

Description
Sources: DOI: 10.1080/01483919108049698

Doretinel is a member of a class of compounds known collectively as retinoids. As a topical gel, it was being studied for its potential use as a dermatological product.

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:09:56 GMT 2023` Edited by `admin` on `Fri Dec 15 15:09:56 GMT 2023`
Record UNII	G71TK93T5B
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DORETINEL

Official Name

English

ORF-20257

Code

English

ORF 20257

Code

English

doretinel [INN]

Common Name

English

RWJ-20257

Code

English

BASF 47011

Code

English

RWJ 20257

Code

English

DORETINEL [USAN]

Common Name

English

BASF-47011

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C26017

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

Code System Code Type Description

USAN

AA-53

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

INN

6377

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

CAS

104561-36-6

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

PUBCHEM

6435712

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

SMS_ID

100000080766

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

EVMPD

SUB06372MIG

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

FDA UNII

G71TK93T5B

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

NCI_THESAURUS

C77396

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

ChEMBL

CHEMBL2104281

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

EPA CompTox

DTXSID30883146

Created by admin on Fri Dec 15 15:09:56 GMT 2023 , Edited by admin on Fri Dec 15 15:09:56 GMT 2023

PRIMARY

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					908P26PG8R

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					535JZ163EJ

DORETINEL, (R)-

ENANTIOMER -> RACEMATE

Related Record Type Details


					G71TK93T5B

DORETINEL

ACTIVE MOIETY