METOCHALCONE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H18O4
Molecular Weight	298.3331
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of METOCHALCONE

Structure Search

SMILES

COC1=CC=C(\C=C\C(=O)C2=CC=C(OC)C=C2OC)C=C1

InChI

InChIKey=HVAKUYCEWDPRCA-IZZDOVSWSA-N

InChI=1S/C18H18O4/c1-20-14-7-4-13(5-8-14)6-11-17(19)16-10-9-15(21-2)12-18(16)22-3/h4-12H,1-3H3/b11-6+

HIDE SMILES / InChI

Description
Sources: Dressler, H. (2013) Resorcinol: Its Uses and Derivatives, page 182, retrieved from: https://books.google.ru/books?id=6IkHCAAAQBAJ | DOI: 10.1039/C7RA08639C | https://www.ncbi.nlm.nih.gov/pubmed/13571107 | Buckingham, J. (1994) Dictionary of Natural Products, page 130, retrieved from: https://books.google.ru/books?id=QQ00Uu4_-dIC

Metochalcone is a chalcone. It was isolated from heartwood of Pterocarpus marsupium. It has been approved for clinical use as choleretic and diuretic agent. It was made from 2,4-dihydroxybenzaldehyde (beta-resorcaldehide).

Originator

Approval Year

Conditions

Conditions

Condition	Modality	Targets	Highest Phase	Product
Biliary tract diseases 11 Sources: https://www.ncbi.nlm.nih.gov/pubmed/13571107	Primary		Approved 8429	Lesidrin Approved Use Unknown

PubMed

PubMed

Title	Date	PubMed

Patents

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Name

Type

Language

METOCHALCONE

Official Name

English

2',4,4'-TRIMETHOXYCHALCONE

Systematic Name

English

METOCHALCONE [MI]

Common Name

English

METOCHALCONE [MART.]

Common Name

English

metochalcone [INN]

Common Name

English

Metochalcone [WHO-DD]

Common Name

English

NSC-97905

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C1937

Created by admin on Sat Dec 16 16:51:16 GMT 2023 , Edited by admin on Sat Dec 16 16:51:16 GMT 2023

Code System Code Type Description

NCI_THESAURUS

C66129

Created by admin on Sat Dec 16 16:51:16 GMT 2023 , Edited by admin on Sat Dec 16 16:51:16 GMT 2023

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EPA CompTox

DTXSID9046152

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PUBCHEM

6063342

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ChEMBL

CHEMBL36584

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NSC

97905

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CAS

18493-30-6

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CAS

30925-62-3

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ALTERNATIVE

MESH

C003702

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FDA UNII

1754ZE4075

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SMS_ID

100000080937

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INN

3042

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ECHA (EC/EINECS)

242-377-6

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DRUG CENTRAL

1781

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MERCK INDEX

m348

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Merck Index

EVMPD

SUB08900MIG

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ACTIVE MOIETY


					1754ZE4075