CASIMIROIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H11NO4
Molecular Weight	233.22
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CASIMIROIN

Structure Search

SMILES

COC1=CC(=O)N(C)C2=C3OCOC3=CC=C12

InChI

InChIKey=DPXXJCMMMXZVSW-UHFFFAOYSA-N

InChI=1S/C12H11NO4/c1-13-10(14)5-9(15-2)7-3-4-8-12(11(7)13)17-6-16-8/h3-5H,6H2,1-2H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

Title	Date	PubMed
Synthesis of carbon-11-labeled casimiroin analogues as new potential PET agents for imaging of quinone reductase 2 and aromatase expression in breast cancer.	2010 Dec	20558190

Patents

Patents

Name

Type

Language

CASIMIROIN

Common Name

English

CASIMIROINE

Common Name

English

CASIMIROIN [MI]

Common Name

English

1,3-DIOXOLO(4,5-H)QUINOLIN-8(9H)-ONE, 6-METHOXY-9-METHYL-

Systematic Name

English

6-METHOXY-9-METHYL-1,3-DIOXOLO(4,5-H)QUINOLIN-8(9H)-ONE

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m105

Created by admin on Sat Dec 16 18:15:55 GMT 2023 , Edited by admin on Sat Dec 16 18:15:55 GMT 2023

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Merck Index

CAS

477-89-4

Created by admin on Sat Dec 16 18:15:55 GMT 2023 , Edited by admin on Sat Dec 16 18:15:55 GMT 2023

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DRUG BANK

DB08744

Created by admin on Sat Dec 16 18:15:55 GMT 2023 , Edited by admin on Sat Dec 16 18:15:55 GMT 2023

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PUBCHEM

124075

Created by admin on Sat Dec 16 18:15:55 GMT 2023 , Edited by admin on Sat Dec 16 18:15:55 GMT 2023

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EPA CompTox

DTXSID90197256

Created by admin on Sat Dec 16 18:15:55 GMT 2023 , Edited by admin on Sat Dec 16 18:15:55 GMT 2023

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FDA UNII

1X2A1U6BH3

Created by admin on Sat Dec 16 18:15:55 GMT 2023 , Edited by admin on Sat Dec 16 18:15:55 GMT 2023

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SUBSTANCE RECORD


					1X2A1U6BH3