LANCOTRIONE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H21ClO8S
Molecular Weight	444.883
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of LANCOTRIONE

Structure Search

SMILES

CS(=O)(=O)C1=C(OCCC2OCCO2)C(Cl)=C(C=C1)C(=O)C3C(=O)CCCC3=O

InChI

InChIKey=LCENPEOVNAWOSE-UHFFFAOYSA-N

InChI=1S/C19H21ClO8S/c1-29(24,25)14-6-5-11(18(23)16-12(21)3-2-4-13(16)22)17(20)19(14)28-8-7-15-26-9-10-27-15/h5-6,15-16H,2-4,7-10H2,1H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

LANCOTRIONE

Official Name

English

2-CYCLOHEXEN-1-ONE, 2-(2-CHLORO-3-(2-(1,3-DIOXOLAN-2-YL)ETHOXY)-4-(METHYLSULFONYL)BENZOYL)-3-HYDROXY-

Common Name

English

2-(2-CHLORO-3-(2-(1,3-DIOXOLAN-2-YL)ETHOXY)-4-(METHYLSULFONYL)BENZOYL)-3-HYDROXY-2-CYCLOHEXEN-1-ONE

Systematic Name

English

1,3-CYCLOHEXANEDIONE, 2-(2-CHLORO-3-(2-(1,3-DIOXOLAN-2-YL)ETHOXY)-4-(METHYLSULFONYL)BENZOYL)-

Systematic Name

English

LANCOTRIONE [ISO]

Common Name

English

2-(2-CHLORO-3-(2-(1,3-DIOXOLAN-2-YL)ETHOXY)-4-(METHYLSULFONYL)BENZOYL)-1,3-CYCLOHEXANEDIONE

Systematic Name

English

Code System Code Type Description

CAS

871037-44-4

Created by admin on Sat Dec 16 18:59:30 GMT 2023 , Edited by admin on Sat Dec 16 18:59:30 GMT 2023

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CAS

1486617-21-3

Created by admin on Sat Dec 16 18:59:30 GMT 2023 , Edited by admin on Sat Dec 16 18:59:30 GMT 2023

ALTERNATIVE

PUBCHEM

11612020

Created by admin on Sat Dec 16 18:59:30 GMT 2023 , Edited by admin on Sat Dec 16 18:59:30 GMT 2023

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EPA CompTox

DTXSID401337393

Created by admin on Sat Dec 16 18:59:30 GMT 2023 , Edited by admin on Sat Dec 16 18:59:30 GMT 2023

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FDA UNII

KMQ9P5LG22

Created by admin on Sat Dec 16 18:59:30 GMT 2023 , Edited by admin on Sat Dec 16 18:59:30 GMT 2023

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ALANWOOD

lancotrione

Created by admin on Sat Dec 16 18:59:30 GMT 2023 , Edited by admin on Sat Dec 16 18:59:30 GMT 2023

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SUBSTANCE RECORD


					KMQ9P5LG22