FRONEPIDIL

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	MIXED
Molecular Formula	C21H31NO2
Molecular Weight	329.4763
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of FRONEPIDIL

Structure Search

SMILES

CC(C)COCC(COC(C)(C#C)C1=CC=CC=C1)N2CCCC2

InChI

InChIKey=BFXRCMJRKTUNIQ-UHFFFAOYSA-N

InChI=1S/C21H31NO2/c1-5-21(4,19-11-7-6-8-12-19)24-17-20(16-23-15-18(2)3)22-13-9-10-14-22/h1,6-8,11-12,18,20H,9-10,13-17H2,2-4H3

HIDE SMILES / InChI

Molecular Formula	C21H31NO2
Molecular Weight	329.4763
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:31:21 GMT 2025` Edited by `admin` on `Mon Mar 31 18:31:21 GMT 2025`
Record UNII	94JPL25DUK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FRONEPIDIL

Official Name

English

fronepidil [INN]

Preferred Name

English

1-(1-(ISOBUTOXYMETHYL)-2-((1-METHYL-1-PHENYL-2-PROPYNYL)OXY)ETHYL)PYRROLIDINE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29707

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

Code System Code Type Description

INN

6135

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

PRIMARY

PUBCHEM

219076

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

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CAS

79700-63-3

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

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EVMPD

SUB07816MIG

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

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NCI_THESAURUS

C65771

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

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FDA UNII

94JPL25DUK

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

PRIMARY

EPA CompTox

DTXSID40868540

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

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ChEMBL

CHEMBL2105065

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

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SMS_ID

100000080467

Created by admin on Mon Mar 31 18:31:21 GMT 2025 , Edited by admin on Mon Mar 31 18:31:21 GMT 2025

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					94JPL25DUK

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