isocyanuric acid (CHEBI:17696)

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ChEBI Name	isocyanuric acid

ChEBI ID	CHEBI:17696

Definition	The keto tautomer of cyanuric acid.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:23439

Supplier Information

Download	Molfile XML SDF

Formula

C3H3N3O3

Net Charge

Average Mass

129.07434

Monoisotopic Mass

129.01744

InChI

InChI=1S/C3H3N3O3/c7-1-4-2(8)6-3(9)5-1/h(H3,4,5,6,7,8,9)

InChIKey

ZFSLODLOARCGLH-UHFFFAOYSA-N

SMILES

O=c1[nH]c(=O)[nH]c(=O)[nH]1

Roles Classification
Biological Role(s):	xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.

ChEBI Ontology
Outgoing	isocyanuric acid (CHEBI:17696) has role xenobiotic (CHEBI:35703) isocyanuric acid (CHEBI:17696) is a 1,3,5-triazinanes (CHEBI:38779) isocyanuric acid (CHEBI:17696) is tautomer of cyanuric acid (CHEBI:38028)

Incoming	1,3,5-tris(6-isocyanatohexyl)-1,3,5-triazin-2,4,6-trione (CHEBI:59098) has functional parent isocyanuric acid (CHEBI:17696) melamine cyanurate (CHEBI:60153) has part isocyanuric acid (CHEBI:17696) cyanuric acid (CHEBI:38028) is tautomer of isocyanuric acid (CHEBI:17696)

IUPAC Name

1,3,5-triazinane-2,4,6-trione

Citation	Type	Source
15909931	PubMed citation	Europe PMC

Last Modified

29 June 2015