RONACTOLOL

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C20H26N2O4
Molecular Weight	358.4314
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of RONACTOLOL

Structure Search

SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=C(OCC(O)CNC(C)C)C=C2

InChI

InChIKey=BPNZFFWEUGGXMC-UHFFFAOYSA-N

InChI=1S/C20H26N2O4/c1-14(2)21-12-17(23)13-26-19-10-6-16(7-11-19)22-20(24)15-4-8-18(25-3)9-5-15/h4-11,14,17,21,23H,12-13H2,1-3H3,(H,22,24)

HIDE SMILES / InChI

Molecular Formula	C20H26N2O4
Molecular Weight	358.4314
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/1355791 | https://www.tandfonline.com/doi/abs/10.1517/13543776.2.1.51?journalCode=ietp19

Ronactolol is an aminopropanol derivative and a beta-adrenergic receptor antagonist. This compound has been withdrawn from development.

Approval Year

Targets

Targets

Primary Target	Pharmacology	Condition	Potency
Adrenergic receptor beta 87 Target ID: CHEMBL2094118 Sources: https://www.ncbi.nlm.nih.gov/pubmed/1355791	Antagonist 2778

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:39:18 GMT 2023` Edited by `admin` on `Sat Dec 16 16:39:18 GMT 2023`
Record UNII	PJ691WQY08
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RONACTOLOL

Official Name

English

ronactolol [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29576

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

Code System Code Type Description

EVMPD

SUB10376MIG

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

PRIMARY

CAS

90895-85-5

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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PUBCHEM

65824

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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WIKIPEDIA

Ronactolol

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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SMS_ID

100000084376

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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EPA CompTox

DTXSID20869070

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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NCI_THESAURUS

C72618

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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MESH

C076562

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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FDA UNII

PJ691WQY08

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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INN

6077

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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ChEMBL

CHEMBL1742404

Created by admin on Sat Dec 16 16:39:18 GMT 2023 , Edited by admin on Sat Dec 16 16:39:18 GMT 2023

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					PJ691WQY08

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