MOFAROTENE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C29H39NO2
Molecular Weight	433.6255
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C\C(=C/C1=CC=C(OCCN2CCOCC2)C=C1)C3=CC4=C(C=C3)C(C)(C)CCC4(C)C

InChI

InChIKey=OUQPTBCOEKUHBH-LSDHQDQOSA-N

InChI=1S/C29H39NO2/c1-22(24-8-11-26-27(21-24)29(4,5)13-12-28(26,2)3)20-23-6-9-25(10-7-23)32-19-16-30-14-17-31-18-15-30/h6-11,20-21H,12-19H2,1-5H3/b22-20+

HIDE SMILES / InChI

Molecular Formula	C29H39NO2
Molecular Weight	433.6255
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/10378670

Mofarotene is an analog of retinoic acid patented by a Swiss multinational healthcare company Hoffmann-La Roche as neoplasm inhibitors and agent for treating dermatoses. Like other retinoic acid agents, mofarotene binds to and activates retinoic acid receptors (RARs), thereby altering the expression of certain genes leading to cell differentiation and decreased cell proliferation in susceptible cells. Mofarotene has demonstrated considerable antitumor activity in a number of cancer cell lines. Mofarotene in combination with cisplatin and etoposide was studied in phase I clinical trials but further development was discontinued.

Originator

Approval Year

PubMed

Title	Date	PubMed
Phase I and pharmacologic study of the arotinoid Ro 40-8757 in combination with cisplatin and etoposide in patients with non-small cell lung cancer.	1999 Apr	10378670

Patents

Sample Use Guides

In Vivo Use Guide

The doses of Ro 40-8757 ranged from 84 mg/m2 once daily to 42 mg/m2 thrice daily (tid).

Route of Administration: Intravenous

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:31:24 GMT 2023` Edited by `admin` on `Fri Dec 15 15:31:24 GMT 2023`
Record UNII	8K3CVY8F8V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MOFAROTENE

Official Name

English

4-(2-(4-((E)-2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPHTHYL)PROPENYL)PHENYLOXY)ETHYL)MORPHOLINE

Systematic Name

English

mofarotene [INN]

Common Name

English

MOFAROTENE [MI]

Common Name

English

RO 40-8757

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C804