3–Acetyldeoxy Nivalenol–13C17

cas: 1217476-81-7 — see every product listed under this CAS number, including other names

3–Acetyldeoxy Nivalenol–13C17 (CAS 1217476-81-7) is a chemical reagent available from Chemat. Available pack sizes: 1,2ml. Offered by: GLPBio.

brandGLPBio
catalog numberGC46582-1.2
cas1217476-81-7
size1,2ml
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Available pack sizes

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GLPBio 1,2ml 11867.68 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

[(1'S,2'R,3'S,7'R,9'R,10'R)-3'-hydroxy-2'-(hydroxy(113C)methyl)-1',5'-di((113C)methyl)-4'-oxospiro[(2,3-13C2)oxirane-2,12'-8-oxatricyclo[7.2.1.02,7]dodec-5-ene]-10'-yl] acetate (CAS 1217476-81-7) is a chemical compound with the molecular formula C17H22O7 and a molecular weight of 355.23 g/mol. IUPAC name: [(1'S,2'R,3'S,7'R,9'R,10'R)-3'-hydroxy-2'-(hydroxy(113C)methyl)-1',5'-di((113C)methyl)-4'-oxospiro[(2,3-13C2)oxirane-2,12'-8-oxatricyclo[7.2.1.02,7]dodec-5-ene]-10'-yl] acetate. InChIKey: ADFIQZBYNGPCGY-QKZVWBIKSA-N.

Identity
Molecular formulaC17H22O7
Molecular weight355.23 g/mol
IUPAC name[(1'S,2'R,3'S,7'R,9'R,10'R)-3'-hydroxy-2'-(hydroxy(113C)methyl)-1',5'-di((113C)methyl)-4'-oxospiro[(2,3-13C2)oxirane-2,12'-8-oxatricyclo[7.2.1.02,7]dodec-5-ene]-10'-yl] acetate
InChIKeyADFIQZBYNGPCGY-QKZVWBIKSA-N
SMILES[13CH3][13C]1=[13CH][13C@@H]2[13C@]([13C@@H]([13C]1=O)O)([13C@@]3([13CH2][13C@H]([13C@H]([13C]34[13CH2]O4)O2)O[13C](=O)[13CH3])[13CH3])[13CH2]O

Computed by PubChem (NCBI)

Synonyms: 3-Acetyldeoxynivalenol 13C17, 3-Acetyl-deoxynivalenol 13C17 25 |Ig/mL in Acetonitrile, 3-Acetyl-deoxynivalenol 13C17 25 microg/mL in Acetonitrile, 3-Acetyldeoxy Nivalenol-13C17 Solution in Acetonitrile, 25ug/mL
Related forms of this compound
[(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 C17H22O7
Isomers (same molecular formula)
[(1R,2R,3S,7R,9R,10R,12S)-3,10-dihydroxy-1,5-dimethyl-4-oxospiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-yl]methyl acetate C17H22O7
[(1'R,2S,2'R,3'S,7'R,9'R,10'R)-3',10'-dihydroxy-1',5'-di((113C)methyl)-4'-oxospiro[(2,3-13C2)oxirane-2,12'-8-oxatricyclo[7.2.1.02,7]dodec-5-ene]-2'-yl](113C)methyl acetate C17H22O7
[(1'S,2R,3S,3aR,4S,7aS)-2-hydroxy-2,3',4-trimethyl-2',7-dioxospiro[3a,4,5,7a-tetrahydrofuro[2,3-c]pyran-3,6'-cyclohex-3-ene]-1'-yl] acetate C17H22O7
[(1S,2R,3S,5R,6R,7R,9R,12S)-12-(2-hydroxypropan-2-yl)-7-methyl-11-oxospiro[4,10-dioxatetracyclo[7.2.1.02,7.03,5]dodecane-6,2'-oxirane]-2-yl] acetate C17H22O7

Also listed as

3-Acetyl-deoxynivalenol 13C17 25 μg/mL in Acetonitrile Dr. Ehrenstorfer CAS 1217476-81-7
3-Acetyldeoxynivalenol-13C17, 99.0% MedChemExpress CAS 1217476-81-7