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CHEBI:172708 - 3'-Hydroxy-T2 Toxin

ChEBI IDCHEBI:172708
ChEBI Name3'-Hydroxy-T2 Toxin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H34O10
Net Charge0
Average Mass482.526
Monoisotopic Mass482.21520
SMILESCC(=O)OCC12CC(OC(=O)CC(C)(C)O)C(C)=CC1OC1C(O)C(OC(C)=O)C2(C)C12CO2
InChIInChI=1S/C24H34O10/c1-12-7-16-23(10-30-13(2)25,8-15(12)33-17(27)9-21(4,5)29)22(6)19(32-14(3)26)18(28)20(34-16)24(22)11-31-24/h7,15-16,18-20,28-29H,8-11H2,1-6H3
InChIKeyMLDQZNYFEGLVAS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
Roles Classification
Biological Role:
mycotoxin  Poisonous substance produced by fungi.
ChEBI Ontology
Outgoing Relation(s)
3'-Hydroxy-T2 Toxin (CHEBI:172708) is a trichothecene (CHEBI:55517)
IUPAC Name 
[11-acetyloxy-2-(acetyloxymethyl)-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-hydroxy-3-methylbutanoate
Manual XrefsDatabases
HMDB0036601HMDB
35014167ChemSpider