ISOOROTIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H4N2O4
Molecular Weight	156.0963
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISOOROTIC ACID

Structure Search

SMILES

OC(=O)C1=CNC(=O)NC1=O

InChI

InChIKey=ZXYAAVBXHKCJJB-UHFFFAOYSA-N

InChI=1S/C5H4N2O4/c8-3-2(4(9)10)1-6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11)

HIDE SMILES / InChI

Molecular Formula	C5H4N2O4
Molecular Weight	156.0963
Charge	0
Count

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

Approval Year

Targets

Targets

Primary Target	Pharmacology	Condition	Potency
Aspartate 1-decarboxylase 1 Target ID: P9WIL3 Gene ID: 885596.0 Gene Symbol: panD Target Organism: Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) Sources: https://www.ncbi.nlm.nih.gov/pubmed/23029336	Inhibitor 8504

Substance Class	Chemical Created by `admin` on `Tue Apr 01 21:05:16 GMT 2025` Edited by `admin` on `Tue Apr 01 21:05:16 GMT 2025`
Record UNII	G7JYK59EBR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOOROTIC ACID

Common Name

English

NSC-1589

Preferred Name

English

5-PYRIMIDINECARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-2,4-DIOXO-

Common Name

English

NSC-79561

Code

English

5-URACILCARBOXYLIC ACID

Common Name

English

5-CARBOXYURACIL

Common Name

English

Code System Code Type Description

NSC

79561

Created by admin on Tue Apr 01 21:05:16 GMT 2025 , Edited by admin on Tue Apr 01 21:05:16 GMT 2025

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ECHA (EC/EINECS)

245-947-2

Created by admin on Tue Apr 01 21:05:16 GMT 2025 , Edited by admin on Tue Apr 01 21:05:16 GMT 2025

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PUBCHEM

90301

Created by admin on Tue Apr 01 21:05:16 GMT 2025 , Edited by admin on Tue Apr 01 21:05:16 GMT 2025

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CAS

23945-44-0

Created by admin on Tue Apr 01 21:05:16 GMT 2025 , Edited by admin on Tue Apr 01 21:05:16 GMT 2025

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FDA UNII

G7JYK59EBR

Created by admin on Tue Apr 01 21:05:16 GMT 2025 , Edited by admin on Tue Apr 01 21:05:16 GMT 2025

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EPA CompTox

DTXSID1066942

Created by admin on Tue Apr 01 21:05:16 GMT 2025 , Edited by admin on Tue Apr 01 21:05:16 GMT 2025

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NSC

1589

Created by admin on Tue Apr 01 21:05:16 GMT 2025 , Edited by admin on Tue Apr 01 21:05:16 GMT 2025

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CHEBI

17477

Created by admin on Tue Apr 01 21:05:16 GMT 2025 , Edited by admin on Tue Apr 01 21:05:16 GMT 2025

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