triaziquone (CHEBI:27090)

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ChEBI Name	triaziquone

ChEBI ID	CHEBI:27090

Definition	A member of the class of 1,4-benzoquinones that is 1,4-benzoquinone in which three of the ring hydrogens are replaced by aziridin-1-yl groups.

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

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Formula

C12H13N3O2

Net Charge

Average Mass

231.25050

Monoisotopic Mass

231.10078

InChI

InChI=1S/C12H13N3O2/c16-9-7-8(13-1-2-13)12(17)11(15-5-6-15)10(9)14-3-4-14/h7H,1-6H2

InChIKey

PXSOHRWMIRDKMP-UHFFFAOYSA-N

SMILES

O=C1C=C(N2CC2)C(=O)C(N2CC2)=C1N1CC1

Roles Classification
Biological Role(s):	alkylating agent Highly reactive chemical that introduces alkyl radicals into biologically active molecules and thereby prevents their proper functioning. It could be used as an antineoplastic agent, but it might be very toxic, with carcinogenic, mutagenic, teratogenic, and immunosuppressant actions. It could also be used as a component of poison gases.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	triaziquone (CHEBI:27090) has role alkylating agent (CHEBI:22333) triaziquone (CHEBI:27090) has role antineoplastic agent (CHEBI:35610) triaziquone (CHEBI:27090) is a 1,4-benzoquinones (CHEBI:132124) triaziquone (CHEBI:27090) is a aziridines (CHEBI:22681)

IUPAC Name

2,3,5-tris(aziridin-1-yl)-1,4-benzoquinone

Synonyms	Sources
1,1',1''-(3,6-Dioxo-1,4-cyclohexadiene-1,2,4-triyl)trisaziridine	ChemIDplus
2,3,5-Ethylenimine-1,4-benzoquinone	NIST Chemistry WebBook
2,3,5-Tri(1-aziridinyl)-p-benzoquinone	NIST Chemistry WebBook
2,3,5-Tri-(1-aziridinyl)-p-benzoquinone	ChemIDplus
2,3,5-Triethyleneimino-1,4-benzoquinone	ChemIDplus
2,3,5-Tris(1-aziridino)-p-benzoquinone	ChemIDplus
2,3,5-Tris(1-aziridinyl)-2,5-cyclohexadiene-1,4-dione	NIST Chemistry WebBook
2,3,5-Tris(1-aziridinyl)-p-benzoquinone	ChemIDplus
2,3,5-Tris(aziridino)-1,4-benzoquinone	ChemIDplus
2,3,5-Tris(ethyleneimino)-1,4-benzoquinone	ChemIDplus
2,3,5-Tris(ethylenimino)-1,4-benzoquinone	ChemIDplus
2,3,5-Tris(ethylenimino)-p-benzoquinone	ChemIDplus
2,3,5-Tris(ethylenimino)benzoquinone	ChemIDplus
2,3,5-Trisethyleneiminobenzoquinone	ChemIDplus
Triazichon	ChemIDplus
Triethyleneaminobenzoquinone	ChemIDplus
Tris(1-aziridinyl)-p-benzoquinone	ChemIDplus
Tris(aziridinyl)-p-benzoquinone	NIST Chemistry WebBook
Tris(aziridinyl)-para-benzoquinone	KEGG COMPOUND
Tris(ethyleneimino)benzoquinone	ChemIDplus

Last Modified

22 February 2017