Toxin T 2 triol

CAS Registry Number®

34114-98-2
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CAS Name

Toxin T 2 triol

Molecular Formula

C20H30O7

Molecular Mass

382.45

Cite this Page

Toxin T 2 triol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=34114-98-2 (retrieved 2024-04-28) (CAS RN: 34114-98-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H30O7/c1-10(2)5-14(22)26-12-7-19(8-21)13(6-11(12)3)27-17-15(23)16(24)18(19,4)20(17)9-25-20/h6,10,12-13,15-17,21,23-24H,5,7-9H2,1-4H3/t12-,13+,15+,16+,17+,18+,19+,20-/m0/s1

InChIKey

InChIKey=DDAUKBBLCGQHIP-CAVDVMKYSA-N

SMILES

C[C@]12[C@@]3([C@](O[C@]4([C@]1(CO)C[C@H](OC(CC(C)C)=O)C(C)=C4)[H])([C@H](O)[C@H]2O)[H])CO3

Canonical SMILES

O=C(OC1C(=CC2OC3C(O)C(O)C(C)(C43OC4)C2(CO)C1)C)CC(C)C

Other Names for this Substance

  • Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 8-(3-methylbutanoate), (3α,4β,8α)-
  • Trichothec-9-ene-3α,4β,8α,15-tetrol, 12,13-epoxy-, 8-isovalerate
  • Spiro[2,5-methano-1-benzoxepin-10,2′-oxirane], trichothec-9-ene-3,4,8,15-tetrol deriv.
  • Deacetyl HT 2 toxin
  • Toxin T 2 triol

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Deleted or Replaced CAS Registry Numbers

97373-21-2

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