Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Deoxynivalenol
RN: 51481-10-8
UNII: JT37HYP23V
InChIKey: LINOMUASTDIRTM-QGRHZQQGSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data
  • Natural Product
  • Reproductive Effect
  • Skin / Eye Irritant
  • Tumor Data

Molecular Formula

  • C15-H20-O6

Molecular Weight

  • 296.317
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Deoxynivalenol
  • Vomitoxin

Synonyms

  • 12,13-Epoxy-3-alpha,7-alpha,15-trihydroxy-9-trichothecen-8-one
  • 4-Deoxynivalenol
  • 4-Desoxynivalenol
  • CCRIS 7801
  • Dehydronivalenol
  • Deoxynivalenol
  • Desoxynivalenol
  • DON
  • HSDB 7245
  • NSC 269144
  • Rd toxin
  • UNII-JT37HYP23V
  • Vomitoxin

Systematic Names

  • 3alpha,7alpha,15-Trihydroxy-12,13-epoxytrichothec-9-en-8-one
  • Deoxynivalenol
  • Trichothec-9-en-8-one, 12,13-epoxy-3,7,15-trihydroxy-, (3-alpha,7-alpha)-

Superlist Name

  • Deoxynivalenol

Registry Numbers

CAS Registry Number

  • 51481-10-8

FDA UNII

  • JT37HYP23V

Other Registry Numbers

  • 115825-61-1
  • 50722-37-7

System Generated Number

  • 0051481108

Structure Descriptors

InChI

1S/C15H20O6/c1-7-3-9-14(5-16,11(19)10(7)18)13(2)4-8(17)12(21-9)15(13)6-20-15/h3,8-9,11-12,16-17,19H,4-6H2,1-2H3/t8-,9-,11-,12-,13-,14-,15+/m1/s1

InChIKey

LINOMUASTDIRTM-QGRHZQQGSA-N

Smiles

CC1=C[C@@H]2[C@]([C@@H](C1=O)O)([C@]3(C[C@H]([C@H]([C@@]34CO4)O2)O)C)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
chicken LD50 oral 140mg/kg (140mg/kg) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Poultry Science. Vol. 60, Pg. 1412, 1981.
dog LD50 subcutaneous 27mg/kg (27mg/kg)   Veterinary and Human Toxicology. Vol. 25, Pg. 335, 1983.
mouse LD50 intraperitoneal 43mg/kg (43mg/kg)   Toxicon. Vol. 24, Pg. 985, 1986.
mouse LD50 oral 46mg/kg (46mg/kg) GASTROINTESTINAL: ULCERATION OR BLEEDING FROM SMALL INTESTINE

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"
Fundamental and Applied Toxicology. Vol. 4, Pg. S124, 1984.
mouse LD50 subcutaneous 45mg/kg (45mg/kg)   Toxicon. Vol. 24, Pg. 985, 1986.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 152 deg C   EXP
log P (octanol-water) -0.710 (none)   EST
Atmospheric OH Rate Constant 1.44E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.