5-NITROBARBITURIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C4H3N3O5
Molecular Weight	173.0837
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-NITROBARBITURIC ACID

Structure Search

SMILES

[O-][N+](=O)C1C(=O)NC(=O)NC1=O

InChI

InChIKey=ABICJYZKIYUWEE-UHFFFAOYSA-N

InChI=1S/C4H3N3O5/c8-2-1(7(11)12)3(9)6-4(10)5-2/h1H,(H2,5,6,8,9,10)

HIDE SMILES / InChI

Molecular Formula	C4H3N3O5
Molecular Weight	173.0837
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
Structure-activity relationship of ligands of uracil phosphoribosyltransferase from Toxoplasma gondii.	1994 Aug 17	8080452
Virtual combinatorial syntheses and computational screening of new potential anti-herpes compounds.	1999 Aug 26	10464017

Patents

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:19:52 GMT 2023` Edited by `admin` on `Fri Dec 15 15:19:52 GMT 2023`
Record UNII	8WZ923176V
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

5-NITROBARBITURIC ACID

Systematic Name

English

NSC-5071

Code

English

5-NITRO-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE

Systematic Name

English

5-NITROBARBITURIC ACID [MI]

Common Name

English

DILITURIC ACID

Common Name

English

Code System Code Type Description

CAS

480-68-2

Created by admin on Fri Dec 15 15:19:52 GMT 2023 , Edited by admin on Fri Dec 15 15:19:52 GMT 2023

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MERCK INDEX

m7942

Created by admin on Fri Dec 15 15:19:52 GMT 2023 , Edited by admin on Fri Dec 15 15:19:52 GMT 2023

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Merck Index

EPA CompTox

DTXSID0060062

Created by admin on Fri Dec 15 15:19:52 GMT 2023 , Edited by admin on Fri Dec 15 15:19:52 GMT 2023

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MESH

C022044

Created by admin on Fri Dec 15 15:19:52 GMT 2023 , Edited by admin on Fri Dec 15 15:19:52 GMT 2023

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PUBCHEM

10195

Created by admin on Fri Dec 15 15:19:52 GMT 2023 , Edited by admin on Fri Dec 15 15:19:52 GMT 2023

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NSC

5071

Created by admin on Fri Dec 15 15:19:52 GMT 2023 , Edited by admin on Fri Dec 15 15:19:52 GMT 2023

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FDA UNII

8WZ923176V

Created by admin on Fri Dec 15 15:19:52 GMT 2023 , Edited by admin on Fri Dec 15 15:19:52 GMT 2023

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ECHA (EC/EINECS)

207-557-0

Created by admin on Fri Dec 15 15:19:52 GMT 2023 , Edited by admin on Fri Dec 15 15:19:52 GMT 2023

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