Isoneosolaniol

CAS Registry Number®

65180-29-2

CAS Name

Isoneosolaniol

Molecular Formula

C19H26O8

Molecular Mass

382.40

Cite this Page

Isoneosolaniol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=65180-29-2 (retrieved 2024-11-22) (CAS RN: 65180-29-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H26O8/c1-9-5-13-18(7-20,6-12(9)25-10(2)21)17(4)15(26-11(3)22)14(23)16(27-13)19(17)8-24-19/h5,12-16,20,23H,6-8H2,1-4H3/t12-,13+,14+,15+,16+,17+,18+,19-/m0/s1

InChIKey

InChIKey=UROCTWOJYLMRHO-WVJYZQHISA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,8-diacetate, (3α,4β,8α)-
  • Spiro[2,5-methano-1-benzoxepin-10,2′-oxirane], trichothec-9-ene-3,4,8,15-tetrol deriv.
  • Toxin T 1
  • Toxin NT 1
  • Isoneosolaniol

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration