SUMAROTENE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H30O2S
Molecular Weight	382.559
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of SUMAROTENE

Structure Search

SMILES

C\C(=C/C1=CC=C(C=C1)S(C)(=O)=O)C2=CC3=C(C=C2)C(C)(C)CCC3(C)C

InChI

InChIKey=AUCWKKVIBKHRED-BMRADRMJSA-N

InChI=1S/C24H30O2S/c1-17(15-18-7-10-20(11-8-18)27(6,25)26)19-9-12-21-22(16-19)24(4,5)14-13-23(21,2)3/h7-12,15-16H,13-14H2,1-6H3/b17-15+

HIDE SMILES / InChI

Molecular Formula	C24H30O2S
Molecular Weight	382.559
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:46:55 UTC 2023` Edited by `admin` on `Fri Dec 15 15:46:55 UTC 2023`
Record UNII	8896RX4S4J
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

SUMAROTENE

Official Name

English

sumarotene [INN]

Common Name

English

SUMAROTENE [USAN]

Common Name

English

RO 14-9706/000

Code

English

RO-14-9706/000

Code

English

RO-149706000

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C938

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

Code System Code Type Description

SMS_ID

100000082981

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

PRIMARY

CAS

105687-93-2

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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EVMPD

SUB10769MIG

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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EPA CompTox

DTXSID10883164

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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FDA UNII

8896RX4S4J

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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INN

6738

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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ChEMBL

CHEMBL2105526

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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NCI_THESAURUS

C74431

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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USAN

CC-38

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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PUBCHEM

6436127

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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MESH

C069613

Created by admin on Fri Dec 15 15:46:55 UTC 2023 , Edited by admin on Fri Dec 15 15:46:55 UTC 2023

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Related Record Type Details


					8896RX4S4J

ACTIVE MOIETY