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Chemical structure of T-2 Tetraol

GC44980

T-2 Tetraol

Also known as (2R,4S,7R,9R,10R,11S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4,10,11-triol

T-2 Tetraol is a group A trichothecene mycotoxin derived by the metabolism of T-2 toxin

ChemicalCAS34114-99-3MW298.3FormulaC15H22O6
CAS number
34114-99-3
Molecular weight
298.3
Formula
C15H22O6
Solubility
Dichloromethane： 10 mg/ml
InChIKey
ZAXZBJSXSOISTF-VREARNNESA-N
Catalogue number
GC44980
Brand
GLPBIO
Computed properties PubChem CID 104780 · XLogP -2.1 · TPSA 103 Ų · H-bond donors 4
XLogP
-2.1
TPSA
103 Ų
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
1
Heavy atoms
21

SMILES CC1=C[C@@H]2[C@](C[C@@H]1O)(C3([C@@H]([C@H]([C@H](C34CO4)O2)O)O)C)CO

Computed descriptors from PubChem (CID 104780), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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