3-Acetyldeoxynivalenol
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- structure.search.product.name 3-Acetyldeoxynivalenol
- Product Code: TRC-A173505
- CAS Number: 50722-38-8
- Brand: TRC
Product Overview
Product Code
TRC-A173505
CAS Number
Product Format
Neat
Molecular Formula
C17 H22 O7
Molecular Weight
338.35
API Family
NivalenolProduct Categories
TRC, Environmental Food Contaminant Reference Materials , Mycotoxin Research and Reference Materials , Mycotoxin Reference Materials
Product Type
ContaminantDocumentation
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Product Information
Chemical Data
Analyte Name
3-Acetyl-deoxynivalenol
CAS Number
50722-38-8
Molecular Formula
C17 H22 O7
Molecular Weight
338.35
Accurate Mass
338.1366
SMILES
CC(=O)O[C@H]1C[C@]2(C)C3(CO3)[C@H]1O[C@H]4C=C(C)C(=O)[C@H](O)[C@@]24CO
InChI
InChI=1S/C17H22O7/c1-8-4-11-16(6-18,13(21)12(8)20)15(3)5-10(23-9(2)19)14(24-11)17(15)7-22-17/h4,10-11,13-14,18,21H,5-7H2,1-3H3/t10-,11-,13-,14-,15-,16-,17?/m0/s1
IUPAC
[(1R,2R,3S,7R,9R,10R,12S)-3-hydroxy-2-(hydroxymethyl)-1,5-dimethyl-4-oxospiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Contaminant
Product Format
Neat
API Family
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