3-Acetyldeoxynivalenol

• Catalog Number: ACM50722388
• Product Name: 3-Acetyldeoxynivalenol
• CAS: 50722-38-8
• Category: Heterocyclic Organic Compound
• 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
• Molecular Weight: 338.35
• Molecular Formula: C17H22O7
• 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

Custom Q&A

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.