XENTHIORATE HYDROCHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C22H29NOS.ClH
Molecular Weight	391.998
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CCC(C(=O)SCCN(CC)CC)C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChIKey=DMDLAKHJLZVWFB-UHFFFAOYSA-N

InChI=1S/C22H29NOS.ClH/c1-4-21(22(24)25-17-16-23(5-2)6-3)20-14-12-19(13-15-20)18-10-8-7-9-11-18;/h7-15,21H,4-6,16-17H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula	C22H29NOS
Molecular Weight	355.537
Charge	0
Count

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

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: Ganellin C.R., Triggle David J., Dictionary of Pharmacological Agents, p. 585, retrieved from:https://books.google.ru/books?id=Z_mfTTIApVEC&pg=PA584&lpg=PA584&dq=XENTHIORATE&source=bl&ots=EtGIIrRIB_&sig=ACfU3U3nwBV3ZV9tWmRrHDjS6TeEDPgwhg&hl=ru&sa=X&ved=2ahUKEwi1ooKB8LLjAhXzwcQBHddfC3Q4FBDoATAEegQIBxAB#v=onepage&q=XENTHIORATE&f=false

Xenthiorate was studied as an antihyperlipidemic agent. Information about the current use of this agent is not available.

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
cholesterol metabolic process 6 Target ID: GO:0008203 Sources: https://books.google.ru/books?id=0vXTBwAAQBAJ&pg=PA1292&dq=xenthiorate retrieved from The Dictionary of Drugs: Chemical Data: Chemical Data, Structures and Bibliographies. J. Elks.p.1292	Modulator 828

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:36:49 GMT 2023` Edited by `admin` on `Sat Dec 16 10:36:49 GMT 2023`
Record UNII	9C1673620A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

XENTHIORATE HYDROCHLORIDE

Common Name

English

W-1816

Code

English

BUTYRIC ACID, 2-(4-BIPHENYLYL)THIO-, S-(2-(DIETHYLAMINO)ETHYL) ESTER, HYDROCHLORIDE

Systematic Name

English

(1,1'-BIPHENYL)-4-ETHANETHIOIC ACID, .ALPHA.-ETHYL-, S-(2-(DIETHYLAMINO)ETHYL) ESTER, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

9C1673620A

Created by admin on Sat Dec 16 10:36:50 GMT 2023 , Edited by admin on Sat Dec 16 10:36:50 GMT 2023

PRIMARY

PUBCHEM

117068974

Created by admin on Sat Dec 16 10:36:50 GMT 2023 , Edited by admin on Sat Dec 16 10:36:50 GMT 2023

PRIMARY

CAS

7320-74-3

Created by admin on Sat Dec 16 10:36:50 GMT 2023 , Edited by admin on Sat Dec 16 10:36:50 GMT 2023

PRIMARY

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