Toxin T 2 triol
CAS Registry Number®
34114-98-2
CAS Name
Toxin T 2 triolMolecular Formula
C20H30O7Molecular Mass
382.45Cite this Page
Toxin T 2 triol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=34114-98-2 (retrieved ) (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
Deleted or Replaced CAS Registry Numbers
97373-21-2