CAS 88337-96-6|15-Acetyl-deoxynivalenol

Introduction:Basic information about CAS 88337-96-6|15-Acetyl-deoxynivalenol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name15-Acetyl-deoxynivalenol
CAS Number88337-96-6Molecular Weight338.35200
Density1.42g/cm3Boiling Point518.8ºC at 760 mmHg
Molecular FormulaC17H22O7Melting Point185°C-187°C
MSDSChineseUSAFlash Point2ºC
Symbol
GHS06
Signal WordDanger

Names

Name15-acetoxy-3alpha,7alpha-dihydroxy-12,13-epoxytrichothec-9-en-8-one
SynonymMore Synonyms

15-Acetyl-deoxynivalenol BiologicalActivity

Description15-Acetyl-deoxynivalenol is a highly toxic trichothecene found in cereals, and a metabolite of deoxynivalenol, exhibits toxicity to HepG2 cells[1].
Related CatalogResearch Areas >>Cancer
References

[1]. Juan-García A, et al. Binary and tertiary combination of alternariol, 3-acetyl-deoxynivalenol and 15-acetyl-deoxynivalenol on HepG2 cells: Toxic effects and evaluation of degradation products. Toxicol In Vitro. 2016 Aug;34:264-273.

Chemical & Physical Properties

Density1.42g/cm3
Boiling Point518.8ºC at 760 mmHg
Melting Point185°C-187°C
Molecular FormulaC17H22O7
Molecular Weight338.35200
Flash Point2ºC
Exact Mass338.13700
PSA105.59000
Index of Refraction1.595
InChIKeyIDGRYIRJIFKTAN-HTJQZXIKSA-N
SMILESCC(=O)OCC12C(C=C(C)C(=O)C1O)OC1C(O)CC2(C)C12CO2
Storage condition2-8°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YD0155000
CHEMICAL NAME :
Trichothec-9-en-8-one, 15-(acetyloxy)-12,13-epoxy-3,7-dihydroxy-, (3-alpha,7-alpha)-
CAS REGISTRY NUMBER :
88337-96-6
LAST UPDATED :
198708
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C17-H22-O7
MOLECULAR WEIGHT :
338.39

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
34 mg/kg
TOXIC EFFECTS :
Gastrointestinal - ulceration or bleeding from small intestine Kidney, Ureter, Bladder - inflammation, necrosis, or scarring of bladder Blood - changes in spleen
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 25,155,1987
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
113 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AEMIDF Applied and Environmental Microbiology. (American Soc. for Microbiology, 1913 I St., NW, Washington, DC 20006) V.31- 1976- Volume(issue)/page/year: 50,1304,1985

Safety Information

Symbol
GHS06
Signal WordDanger
Hazard StatementsH300-H311-H331
Precautionary StatementsP261-P264-P280-P301 + P310-P311
Personal Protective EquipmentEyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges
Hazard CodesT,Xn,F
Risk Phrases23/24/25-36-20/21/22-11
Safety Phrases36/37-45-26
RIDADRUN 2811 6.1/PG 2
WGK Germany3
RTECSYD0155000
Packaging GroupI
Hazard Class6.1(a)
HS Code29329990

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Synonyms

15-ADON
15-ACETYLDEOXYNIVALENOL
Deoxynivalenol 15-Acetate
15-acetoxy-3,7-dihydroxy-12,13-epoxytrichothec-9-en-8-one
15-O-acetyl-4-deoxynivalenol
15-ACETYLVOMITOXIN
15-acetyl
15-Acetyl-4-deoxynivalenol
3-ACETYL-D3-DEOXYNIVALENOL
15-ACDON
DON-15-acetate
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