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Substance Name: Sambucinol
RN: 90044-33-0
UNII: VYS174Q62V
InChIKey: GFLMBFRNOPTZDK-CYJZHVFYSA-N

Note

  • Fusarium culmorum metabolite.

Molecular Formula

  • C15-H22-O4

Molecular Weight

  • 266.3348
 
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Names and Synonyms

Name of Substance

  • Sambucinol

Synonym

  • UNII-VYS174Q62V

Systematic Name

  • Trichothec-9-ene-3,13-diol, 11,12-epoxy-, (3beta,11beta,12R)-

Registry Numbers

CAS Registry Number

  • 90044-33-0

FDA UNII

  • VYS174Q62V

System Generated Number

  • 0090044330

Structure Descriptors

InChI

1S/C15H22O4/c1-9-4-5-12(2)13(3)7-10(17)11-14(13,8-16)19-15(12,6-9)18-11/h6,10-11,16-17H,4-5,7-8H2,1-3H3/t10-,11-,12+,13+,14+,15?/m0/s1

InChIKey

GFLMBFRNOPTZDK-CYJZHVFYSA-N

Smiles

CC1=CC23[C@](CC1)([C@]4(C[C@@H]([C@@H]([C@]4(O2)CO)O3)O)C)C