4-OXO-4-(3-PYRIDINEBUTANAL)

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H9NO2
Molecular Weight	163.1733
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-OXO-4-(3-PYRIDINEBUTANAL)

Structure Search

SMILES

O=CCCC(=O)C1=CN=CC=C1

InChI

InChIKey=CFONOJVUTZAMCB-UHFFFAOYSA-N

InChI=1S/C9H9NO2/c11-6-2-4-9(12)8-3-1-5-10-7-8/h1,3,5-7H,2,4H2

HIDE SMILES / InChI

Molecular Formula	C9H9NO2
Molecular Weight	163.1733
Charge	0
Count

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

Approval Year

PubMed

PubMed

Title	Date	PubMed
Functional identification of two novel genes from Pseudomonas sp. strain HZN6 involved in the catabolism of nicotine.	2012-04	22267672

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:03:35 GMT 2025` Edited by `admin` on `Mon Mar 31 19:03:35 GMT 2025`
Record UNII	82739XE26C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-OXO-4-(3-PYRIDINEBUTANAL)

Preferred Name

English

Code System Code Type Description

MESH

C062145

Created by admin on Mon Mar 31 19:03:35 GMT 2025 , Edited by admin on Mon Mar 31 19:03:35 GMT 2025

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CAS

76014-80-7

Created by admin on Mon Mar 31 19:03:35 GMT 2025 , Edited by admin on Mon Mar 31 19:03:35 GMT 2025

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CHEBI

66879

Created by admin on Mon Mar 31 19:03:35 GMT 2025 , Edited by admin on Mon Mar 31 19:03:35 GMT 2025

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EPA CompTox

DTXSID80226923

Created by admin on Mon Mar 31 19:03:35 GMT 2025 , Edited by admin on Mon Mar 31 19:03:35 GMT 2025

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PUBCHEM

115084

Created by admin on Mon Mar 31 19:03:35 GMT 2025 , Edited by admin on Mon Mar 31 19:03:35 GMT 2025

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FDA UNII

82739XE26C

Created by admin on Mon Mar 31 19:03:35 GMT 2025 , Edited by admin on Mon Mar 31 19:03:35 GMT 2025

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