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Substance Name: Trichothec-9-en-8-one, 15-(acetyloxy)-12,13-epoxy-3,4,7-trihydroxy-, (3alpha,4beta,7alpha)-
RN: 68165-52-6
InChIKey: FBXXVJXDIZNZLY-IZEYKREJSA-N

Molecular Weight

  • 354.353
 
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Names and Synonyms

  • Trichothec-9-en-8-one, 15-(acetyloxy)-12,13-epoxy-3,4,7-trihydroxy-, (3alpha,4beta,7alpha)-

Registry Numbers

CAS Registry Number

  • 68165-52-6

System Generated Number

  • 0068165526

Structure Descriptors

InChI

1S/C17H22O8/c1-7-4-9-16(5-23-8(2)18,13(22)10(7)19)15(3)12(21)11(20)14(25-9)17(15)6-24-17/h4,9,11-14,20-22H,5-6H2,1-3H3/t9-,11-,12-,13-,14-,15-,16-,17?/m1/s1

InChIKey

FBXXVJXDIZNZLY-IZEYKREJSA-N

Smiles

C[C@@]12[C@@H]([C@H]([C@H](O[C@@H]3C=C(C([C@H]([C@@]13COC(=O)C)O)=O)C)[C@@]12CO1)O)O