Isotrichodermin

CAS Registry Number®

91423-90-4

CAS Name

Isotrichodermin

Molecular Formula

C17H24O4

Molecular Mass

292.37

Cite this Page

Isotrichodermin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=91423-90-4 (retrieved 2024-11-24) (CAS RN: 91423-90-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H24O4/c1-10-5-6-15(3)13(7-10)21-14-12(20-11(2)18)8-16(15,4)17(14)9-19-17/h7,12-14H,5-6,8-9H2,1-4H3/t12-,13-,14-,15+,16-,17+/m1/s1

InChIKey

InChIKey=OZXJPPYWZVBMGW-IKIFYQGPSA-N

SMILES

C[C@@]12[C@@]3([C@@]([C@H](OC(C)=O)C1)(O[C@]4([C@]2(C)CCC(C)=C4)[H])[H])CO3

Canonical SMILES

O=C(OC1CC2(C)C3(OC3)C1OC4C=C(C)CCC42C)C

Other Names for this Substance

  • Trichothec-9-en-3-ol, 12,13-epoxy-, 3-acetate, (3α)-
  • Trichothec-9-en-3-ol, 12,13-epoxy-, acetate, (3α)-
  • Spiro[2,5-methano-1-benzoxepin-10,2′-oxirane], trichothec-9-en-3-ol deriv.
  • Isotrichodermin

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