Logo Anses
Logo Interreg

3'-hydroxy t-2 toxin

  • Formula: C24H34O10

  • Molecular weight: 482.50

  • Smiles: CC1=CC2C(CC1OC(=O)CC(C)(C)O)(C3(C(C(C(C34CO4)O2)O)OC(=O)C)C)COC(=O)C

  • Type: Trichothecene

Download

3'-hydroxy t-2 toxin

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
Fungi

Names

  • Mycotoxin name: 3'-hydroxy t-2 toxin

  • First synonym: Unii-qh9b9apl9t

  • Synonyms: UNII-QH9B9APL9T,QH9B9APL9T,3'-hydroxy T-2 toxin,3'-Hydroxy T2 toxin,3'-Hydroxy-T-2 toxin,84474-35-1,Q27896361,Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-(3-hydroxy-3-methylbutanoate), (3-alpha,4-beta,8-alpha)-

Identifiers / External links

Structure

  • Smiles: CC1=CC2C(CC1OC(=O)CC(C)(C)O)(C3(C(C(C(C34CO4)O2)O)OC(=O)C)C)COC(=O)C

  • Isomeric smiles: CC1=C[C@@H]2[C@](C[C@@H]1OC(=O)CC(C)(C)O)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)O)OC(=O)C)C)COC(=O)C

  • Inchi: InChI=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/t15-,16+,18+,19+,20+,22+,23+,24-/m0/s1

  • Inchikey: MLDQZNYFEGLVAS-GGTUAJKXSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C24H34O10

  • Molecular weight: 482.50

  • Monoisotopic mass: 482.21519728

Select an endpoint:

Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Sub category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Endpoint Tool Value Unit Comments Reference

Fungi