2-Methylenequinuclidin-3-one

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H11NO
Molecular Weight	137.179
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Methylenequinuclidin-3-one

SMILES

C=C1N2CCC(CC2)C1=O

InChI

InChIKey=NHPWIWAGVOXDPU-UHFFFAOYSA-N

InChI=1S/C8H11NO/c1-6-8(10)7-2-4-9(6)5-3-7/h7H,1-5H2

HIDE SMILES / InChI

Molecular Formula	C8H11NO
Molecular Weight	137.179
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Approval Year

Substance Class	Chemical
Record UNII	YBL6TAE47S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-Methylenequinuclidin-3-one

Systematic Name

English

2-Methylene-3-quinuclidone

Preferred Name

English

2-Methylene-1-azabicyclo[2.2.2]octan-3-one

Systematic Name

English

1-Azabicyclo[2.2.2]octan-3-one, 2-methylene-

Systematic Name

English

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Code System

Code

Type

Description

CAS

5291-26-9

PRIMARY

FDA UNII

YBL6TAE47S

PRIMARY

PUBCHEM

322973

PRIMARY

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Related Record

Type

Details


					UQX4TGR7ZR

2-Methylenequinuclidin-3-one hydrochloride

SALT/SOLVATE -> PARENT

Amount:


					P0MIG0N03Z

CELLULAR TUMOR ANTIGEN P53

TARGET -> ACTIVATOR

Comments:

Methylene quinuclidinone (MQ) that binds covalently to cysteines in p53, leading to refolding and restoration of wild type p53 function

Amount:


					GAN16C9B8O

Glutathione

TARGET -> SUBSTRATE

Amount:


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CELLULAR TUMOR ANTIGEN P53 (Y220C)

TARGET -> ACTIVATOR

Comments:

Methylene quinuclidinone (MQ) that binds covalently to cysteines in p53, leading to refolding and restoration of wild type p53 function

Amount:


					72UT5PQL12

THIOREDOXIN REDUCTASE 1, CYTOPLASMIC

TARGET -> INHIBITOR

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Showing 1 to 5 of 5 entries

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