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Substance Name: 4-O-Acetyltrichothecolone
RN: 4682-54-6
UNII: YY7B0P0407
InChIKey: UGISZOXYFHGCSR-VAGOAYAUSA-N

Molecular Formula

  • C17-H22-O5

Molecular Weight

  • 306.3558
 
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Names and Synonyms

Results Name

  • 4-O-Acetyltrichothecolone

Name of Substance

  • Trichothecolone acetate

Synonyms

  • 4-O-Acetyltrichothecolone
  • UNII-YY7B0P0407

Systematic Name

  • Trichothec-9-en-8-one, 4-(acetyloxy)-12,13-epoxy-, (4beta)-

Registry Numbers

CAS Registry Number

  • 4682-54-6

FDA UNII

  • YY7B0P0407

System Generated Number

  • 0004682546

Structure Descriptors

InChI

1S/C17H22O5/c1-9-5-12-15(3,7-11(9)19)16(4)13(21-10(2)18)6-14(22-12)17(16)8-20-17/h5,12-14H,6-8H2,1-4H3/t12-,13-,14?,15+,16-,17?/m1/s1

InChIKey

UGISZOXYFHGCSR-VAGOAYAUSA-N

Smiles

CC1=C[C@@H]2[C@](CC1=O)([C@]3([C@@H](CC(C34CO4)O2)OC(=O)C)C)C