T-2 toxin (CHEBI:9381)

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CHEBI:9381 - T-2 toxin

ChEBI ID	CHEBI:9381
ChEBI Name	T-2 toxin
Stars
Definition	A trichothecene mycotoxin produced by fungi of the genus Fusarium . It is a common contaminant in food and feedstuffs of cereal origin and is known to cause a range of toxic effects in humans and animals.
Last Modified	23 November 2020
Downloads	Molfile

Formula	C24H34O9
Net Charge	0
Average Mass	466.527
Monoisotopic Mass	466.22028
SMILES	[H][C@@]12C=C(C)[C@@H](OC(=O)CC(C)C)C[C@]1(COC(C)=O)[C@@]1(C)[C@H](OC(C)=O)[C@@H](O)[C@@]([H])(O2)[C@@]12CO2
InChI	InChI=1S/C24H34O9/c1-12(2)7-18(27)32-16-9-23(10-29-14(4)25)17(8-13(16)3)33-21-19(28)20(31-15(5)26)22(23,6)24(21)11-30-24/h8,12,16-17,19-21,28H,7,9-11H2,1-6H3/t16-,17+,19+,20+,21+,22+,23+,24-/m0/s1
InChIKey	BXFOFFBJRFZBQZ-QYWOHJEZSA-N

Wikipedia

Species of Metabolite	Component	Source	Comments
Fusarium graminearum (ncbitaxon:5518)	-	PubMed (16604118)	Strain: Z-3639
Fusarium sporotrichioides (ncbitaxon:5514)	-	PubMed (16604118)	Strain: NRRL3299

Roles Classification

Chemical Role:

environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects.

Biological Roles:

fungal metabolite Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.

mycotoxin Poisonous substance produced by fungi.

neurotoxin A poison that interferes with the functions of the nervous system.

apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.

DNA synthesis inhibitor Any substance that inhibits the synthesis of DNA.

cardiotoxic agent A role played by a chemical compound exhibiting itself through the ability to induce damage to the heart and cardiomyocytes.

mycotoxin Poisonous substance produced by fungi.

ChEBI Ontology

Outgoing Relation(s)
	T-2 toxin (CHEBI:9381) has functional parent HT-2 toxin (CHEBI:138861)
	T-2 toxin (CHEBI:9381) has role apoptosis inducer (CHEBI:68495)
	T-2 toxin (CHEBI:9381) has role cardiotoxic agent (CHEBI:50912)
	T-2 toxin (CHEBI:9381) has role DNA synthesis inhibitor (CHEBI:59517)
	T-2 toxin (CHEBI:9381) has role environmental contaminant (CHEBI:78298)
	T-2 toxin (CHEBI:9381) has role fungal metabolite (CHEBI:76946)
	T-2 toxin (CHEBI:9381) has role mycotoxin (CHEBI:25442)
	T-2 toxin (CHEBI:9381) has role neurotoxin (CHEBI:50910)
	T-2 toxin (CHEBI:9381) is a acetate ester (CHEBI:47622)
	T-2 toxin (CHEBI:9381) is a organic heterotetracyclic compound (CHEBI:38163)
	T-2 toxin (CHEBI:9381) is a trichothecene (CHEBI:55517)

IUPAC Name
4β,15-bis(acetyloxy)-3α-hydroxy-12,13-epoxytrichothec-9-en-8α-yl 3-methylbutanoate

Synonyms	Source
3-hydroxy-4,15-diacetoxy-8-(3-methylbutyryloxy)-12,13-epoxy-δ-9-trichothecene	ChemIDplus
(3α,4β,8α)-12,13-epoxy-4,15-diacetate 8-(3-methylbutanoate)trichothec-9-ene-3,4,8,15-tetrol	ChEBI
4β,15-diacetoxy-3α-hydroxy-8α-(3-methylbutyryloxy)-12,13-epoxytrichothec-9-ene	ChEBI
fusariotoxine T2	ChemIDplus
fusariotoxin T 2	ChemIDplus
fusariotoxin T-2	ChEBI

Manual Xrefs	Databases
4447526	ChemSpider
C00003192	KNApSAcK
C09738	KEGG COMPOUND
CPD-18416	MetaCyc
FDB015515	FooDB
HMDB0036600	HMDB
T-2_mycotoxin	Wikipedia

Registry Numbers	Sources
Reaxys:3575695	Reaxys
CAS:21259-20-1	ChemIDplus
CAS:21259-20-1	NIST Chemistry WebBook

Citations