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Substance Name: 7-Acetyldeoxynivalenol
RN: 54996-64-4
InChIKey: BIEMSLKEYQTVRH-KLOHDQKESA-N

Molecular Formula

  • C17-H22-O7

Molecular Weight

  • 338.354
 
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Names and Synonyms

Results Name

  • 7-Acetyldeoxynivalenol

Synonym

  • 7-Acetyldeoxynivalenol

Systematic Name

  • Trichothec-9-en-8-one, 7-(acetyloxy)-12,13-epoxy-3,15-dihydroxy-, (3alpha,7alpha)-

Registry Numbers

CAS Registry Number

  • 54996-64-4

System Generated Number

  • 0054996644

Structure Descriptors

InChI

1S/C17H22O7/c1-8-4-11-16(6-18,14(12(8)21)23-9(2)19)15(3)5-10(20)13(24-11)17(15)7-22-17/h4,10-11,13-14,18,20H,5-7H2,1-3H3/t10-,11-,13-,14-,15-,16-,17?/m1/s1

InChIKey

BIEMSLKEYQTVRH-KLOHDQKESA-N

Smiles

C1[C@H]([C@H]2O[C@@H]3C=C(C([C@H]([C@@]3([C@@]1(C)[C@@]12CO1)CO)OC(=O)C)=O)C)O