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Substance Name: Deoxynivalenol-3-O-glucoside
RN: 131180-21-7
UNII: HKI01R84M9
InChIKey: PUMXWMGECQIOGB-SMSDQXDJSA-N

Molecular Formula

  • C21-H30-O11

Molecular Weight

  • 458.457
 
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Names and Synonyms

Results Name

  • Deoxynivalenol-3-O-glucoside

Name of Substance

  • Deoxynivalenol 3-glucoside

Synonyms

  • Deoxynivalenol-3-O-glucoside
  • Deoxynivalenol-3beta-glucopyranoside
  • UNII-HKI01R84M9

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 131180-21-7

FDA UNII

  • HKI01R84M9

System Generated Number

  • 0131180217

Structure Descriptors

InChI

1S/C21H30O11/c1-8-3-11-20(6-23,16(28)12(8)24)19(2)4-9(17(32-11)21(19)7-29-21)30-18-15(27)14(26)13(25)10(5-22)31-18/h3,9-11,13-18,22-23,25-28H,4-7H2,1-2H3/t9-,10-,11-,13-,14+,15-,16-,17-,18-,19-,20-,21+/m1/s1

InChIKey

PUMXWMGECQIOGB-SMSDQXDJSA-N

Smiles

CC1=C[C@H]2O[C@@H]3[C@@H](C[C@@](C)([C@]34CO4)[C@@]2(CO)[C@H](O)C1=O)O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O