4-DAMP IODIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H26NO2.I
Molecular Weight	451.3411
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[I-].C[N+]1(C)CCC(CC1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChIKey=WWJHRSCUAQPFQO-UHFFFAOYSA-M

InChI=1S/C21H26NO2.HI/c1-22(2)15-13-19(14-16-22)24-21(23)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18;/h3-12,19-20H,13-16H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C21H26NO2
Molecular Weight	324.4366
Charge	1
Count

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

Molecular Formula	I
Molecular Weight	126.9045
Charge	-1
Count

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

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Muscarinic acetylcholine receptor M3 159 Target ID: CHEMBL245 Sources: https://www.ncbi.nlm.nih.gov/pubmed/8388802 \| https://www.ncbi.nlm.nih.gov/pubmed/2042037 \| https://www.ncbi.nlm.nih.gov/pubmed/8427708	Antagonist 2778		0.31 nM [IC50]
Muscarinic acetylcholine receptor M5 62 Target ID: CHEMBL2035 Sources: https://www.ncbi.nlm.nih.gov/pubmed/26988801	Antagonist 2778		0.32 nM [IC50]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:57:56 UTC 2023` Edited by `admin` on `Sat Dec 16 16:57:56 UTC 2023`
Record UNII	CP6GVV66RG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-DAMP IODIDE

Common Name

English

4-DAMP

Common Name

English

PIPERIDINIUM, 4-((DIPHENYLACETYL)OXY)-1,1-DIMETHYL-, IODIDE

Systematic Name

English

PIPERIDINIUM, 4-((2,2-DIPHENYLACETYL)OXY)-1,1-DIMETHYL-, IODIDE (1:1)

Common Name

English

4-DIPHENYLACETYLOXY-N-METHYLPIPERIDINE METHIODIDE

Systematic Name

English

PIPERIDINIUM, 4-HYDROXY-1,1-DIMETHYL-, IODIDE, DIPHENYLACETATE

Systematic Name

English

4-DAMP METHIODIDE

Systematic Name

English

4-BENZILOYLOXY-N-METHYLPIPERIDINE METHIODIDE

Systematic Name

English

1,1-DIMETHYL-4-DIPHENYLACETOXYPIPERIDINIUM IODIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

CP6GVV66RG