SINAPINE CHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H24NO5.Cl
Molecular Weight	345.818
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Cl-].COC1=CC(\C=C\C(=O)OCC[N+](C)(C)C)=CC(OC)=C1O

InChI

InChIKey=XKMPOGBKXGSVAO-UHFFFAOYSA-N

InChI=1S/C16H23NO5.ClH/c1-17(2,3)8-9-22-15(18)7-6-12-10-13(20-4)16(19)14(11-12)21-5;/h6-7,10-11H,8-9H2,1-5H3;1H

HIDE SMILES / InChI

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

Molecular Formula	C16H23NO5
Molecular Weight	309.3575
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Wed Apr 02 01:08:39 GMT 2025` Edited by `admin` on `Wed Apr 02 01:08:39 GMT 2025`
Record UNII	0J4UUF1HCK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SINAPINE CHLORIDE [MI]

Preferred Name

English

SINAPINE CHLORIDE

Common Name

English

CHOLINE, CHLORIDE, 4-HYDROXY-3,5-DIMETHOXYCINNAMATE

Systematic Name

English

ETHANAMINIUM, 2-((3-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-1-OXO-2-PROPENYL)OXY)-N,N,N-TRIMETHYL-, CHLORIDE

Systematic Name

English

ETHANAMINIUM, 2-((3-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-1-OXO-2-PROPEN-1-YL)OXY)-N,N,N-TRIMETHYL-, CHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

133082719

Created by admin on Wed Apr 02 01:08:39 GMT 2025 , Edited by admin on Wed Apr 02 01:08:39 GMT 2025

PRIMARY

CAS

6484-80-6

Created by admin on Wed Apr 02 01:08:39 GMT 2025 , Edited by admin on Wed Apr 02 01:08:39 GMT 2025

PRIMARY

MERCK INDEX

m9949

Created by admin on Wed Apr 02 01:08:39 GMT 2025 , Edited by admin on Wed Apr 02 01:08:39 GMT 2025

PRIMARY

FDA UNII

0J4UUF1HCK

Created by admin on Wed Apr 02 01:08:39 GMT 2025 , Edited by admin on Wed Apr 02 01:08:39 GMT 2025

PRIMARY

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