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Substance Name: Isotrichodermin
RN: 91423-90-4
InChIKey: OZXJPPYWZVBMGW-DJXIOKRSSA-N

Note

  • Involved in the biosynthesis of Fusarium culmorum.

Molecular Formula

  • C17-H24-O4

Molecular Weight

  • 292.373
 
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Names and Synonyms

Name of Substance

  • Isotrichodermin

Synonym

  • 12,13-Epoxy-trichothec-9-ene-3-ol acetate

Systematic Name

  • Tichothec-9-en-3-ol, 12,13-epoxy-, acetate, (3alpha)-

Registry Numbers

CAS Registry Number

  • 91423-90-4

System Generated Number

  • 0091423904

Structure Descriptors

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

OZXJPPYWZVBMGW-DJXIOKRSSA-N

Smiles

O1[C@@]2([C@@]3([C@@]4(C)CCC(=C[C@H]4O[C@@H]2[C@@H](C3)OC(C)=O)C)C)C1