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Aconitane-20-carboxaldehyde, 8-(acetyloxy)-14-(benzoyloxy)-3,13,15-trihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)-, (1a,3a,6a,14a,15a,16b)- (9CI) is a complex organic compound belonging to the aconitane family. It is characterized by its unique molecular structure, which includes a 20-carboxaldehyde group, an 8-acetyloxy group, a 14-benzoyloxy group, and three hydroxyl groups at positions 3, 13, and 15. Additionally, it has three methoxy groups at positions 1, 6, and 16, and a methoxymethyl group at position 4. The compound's stereochemistry is defined by the (1a,3a,6a,14a,15a,16b) configuration, indicating the spatial arrangement of its atoms. Aconitane-20-carboxaldehyde,8-(acetyloxy)-14-(benzoyloxy)-3,13,15-trihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)-,(1a,3a,6a,14a,15a,16b)- (9CI) is of interest in the field of organic chemistry and may have potential applications in pharmaceuticals or other industries due to its specific structural features.

545-57-3

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545-57-3 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 545-57-3 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 5,4 and 5 respectively; the second part has 2 digits, 5 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 545-57:
(5*5)+(4*4)+(3*5)+(2*5)+(1*7)=73
73 % 10 = 3
So 545-57-3 is a valid CAS Registry Number.

545-57-3Downstream Products

545-57-3Relevant academic research and scientific papers

THE MECHANISM OF THE FORMATION OF OXONITINE BY PERMANGANATE OXIDATION OF ACONITINE

Amiya, Takashi,Kanaiwa, Yoshio,Bando, Hideo,Suginome, Harusada

, p. 859 - 860 (1984)

An isotopic labeling study has shown that the N-formyl group of oxonitine, a product of permanganate oxidation of aconitine in a 95:5 acetone-water, originates from the methylene group of the N-ethyl of aconitine.

OXONITINE REVISITED: ITS MECHANISM OF FORMATION FROM ACONITINE

Kulanthaivel, Palaniappan,Pelletier, S. William

, p. 2351 - 2354 (2007/10/02)

Oxidation of aconitine (2) to oxonitine (1) with KMnO4 proceeds by three mechanisms, involving the CH3 and CH2 carbons of the N-ethyl group and the carbon of the solvent as sources of the N-CHO group of oxonitine.

AN UNUSUAL OXIDATION OF AN N-CH3 GROUP TO AN N-CHO GROUP BY OSMIUM TETROXIDE

Pelletier, S. William,Desai, Haridutt K.,Finer-Moore, Janet,Mody, Naresh V.

, p. 4229 - 4232 (2007/10/02)

Treatment of pyrodelphinine (1) with osmium tetroxide afforded a mixture of the cis-hydroxylation product 2 and an unexpected product 3 in the ratio of 4:1, respectively.Similarly, oxidation of delphinine (5) afforded α-oxodelphinine (6; 75percent) and oxidation of mesaconitine (8) furnished oxonitine (9; 92percent).Thus a very selective oxidation of the N-methyl group of delphinine and mesaconitine is effected by osmium tetroxide.

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