CAS
50651-75-7 Purity
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50651-75-7 Purity
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![(-)-2,3-Bis[(2R,5R)-2,5-dimethylphospholanyl]maleic anhydride(1,5-cyclooctadiene)rhodium(i)tetrafluoroborate](https://resource.alfa-chemistry.com/structure/507224-99-9.gif)
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3-Acetyldeoxynivalenol
CAS
50722-38-8
Catalog Number
ACM50722388
Category
Other Products
Molecular Weight
338.35
Molecular Formula
C17H22O7
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Specification
Synonyms
3-ACDON;3-ACETYLDEOXYNIVALENOL;3ALPHA-ACETOXY-7ALPHA, 15-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-EN-8-ONE;3ALPHA-ACETYLVOMITOXIN;3-ADON;3-(acetyloxy)-7,15-dihydroxy-,(3-alpha,7-alpha)-trichothec-9-en-8-on;3-acetyldon;dehydronivalenolmonoacetate
Flash Point
2°C
Hazard Statements
T,Xn,F
Safety Description
36/37-45-26-16
Supplemental Hazard Statements
H225-H302-H312-H319-H332-H300-H311+H331-H311-H331
Symbol
GHS06,GHS02,GHS07
What is the molecular formula of 3-acetyldeoxynivalenol?
The molecular formula of 3-acetyldeoxynivalenol is C17H22O7.
What is the molecular weight of 3-acetyldeoxynivalenol?
The molecular weight of 3-acetyldeoxynivalenol is 338.4 g/mol.
Is 3-acetyldeoxynivalenol a natural product?
Yes, 3-acetyldeoxynivalenol is a natural product found in Fusarium culmorum and Fusarium graminearum.
Is 3-acetyldeoxynivalenol considered a skin and eye irritant?
Yes, 3-acetyldeoxynivalenol is considered a skin and eye irritant.
What is the IUPAC name of 3-acetyldeoxynivalenol?
The IUPAC name of 3-acetyldeoxynivalenol is [(1R,2R,3S,7R,9R,10R,12S)-3-hydroxy-2-(hydroxymethyl)-1,5-dimethyl-4-oxospiro[8-oxatricyclo[7.2.1.0 2,7 ]dodec-5-ene-12,2'-oxirane]-10-yl] acetate.
What is the InChI of 3-acetyldeoxynivalenol?
The InChI of 3-acetyldeoxynivalenol is 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+/m1/s1.
What is the InChIKey of 3-acetyldeoxynivalenol?
The InChIKey of 3-acetyldeoxynivalenol is ADFIQZBYNGPCGY-HTJQZXIKSA-N.
How many hydrogen bond donor counts does 3-acetyldeoxynivalenol have?
3-acetyldeoxynivalenol has 2 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does 3-acetyldeoxynivalenol have?
3-acetyldeoxynivalenol has 7 hydrogen bond acceptor counts.
What is the topological polar surface area of 3-acetyldeoxynivalenol?
The topological polar surface area of 3-acetyldeoxynivalenol is 106 ?2.
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