226916-29-6

Basic information

• Product Name: (1'R,3a'R,4a'R,8a'R,9'R,9a'S)-1',8a'-dimethyl-3'-oxodecahydro-1'H-spiro[[1,3]dioxolane-2,6'-naphtho[2,3-c]furan]-9'-carbaldehyde
• Synonyms: (1'R,3a'R,4a'R,8a'R,9'R,9a'S)-1',8a'-dimethyl-3'-oxodecahydro-1'H-spiro[[1,3]dioxolane-2,6'-naphtho[2,3-c]furan]-9'-carbaldehyde;(1'R,3'aR,4'aR,8'aR,9'S,9'aS)-Decahydro-1'-methyl-3'-oxo-spiro[1,3-dioxolane-2,6'(3'H)-naphtho[2,3-c]furan]-9'-carboxaldehyde
• CAS NO: 226916-29-6
• Molecular Formula: C₁₆H₂₂O₅
• Molecular Weight: 308.36946
• Mol File: 226916-29-6.mol
• Article Data: 1

Chemical Properties

• Appearance: /
• CAS DataBase Reference: (1'R,3a'R,4a'R,8a'R,9'R,9a'S)-1',8a'-dimethyl-3'-oxodecahydro-1'H-spiro[[1,3]dioxolane-2,6'-naphtho[2,3-c]furan]-9'-carbaldehyde(CAS DataBase Reference)
• NIST Chemistry Reference: (1'R,3a'R,4a'R,8a'R,9'R,9a'S)-1',8a'-dimethyl-3'-oxodecahydro-1'H-spiro[[1,3]dioxolane-2,6'-naphtho[2,3-c]furan]-9'-carbaldehyde(226916-29-6)
• EPA Substance Registry System: (1'R,3a'R,4a'R,8a'R,9'R,9a'S)-1',8a'-dimethyl-3'-oxodecahydro-1'H-spiro[[1,3]dioxolane-2,6'-naphtho[2,3-c]furan]-9'-carbaldehyde(226916-29-6)

Safety Data

• Hazardous Substances Data: 226916-29-6(Hazardous Substances Data)

Usage

Description

(1'R,3a'R,4a'R,8a'R,9'R,9a'S)-1',8a'-dimethyl-3'-oxodecahydro-1'H-spiro[[1,3]dioxolane-2,6'-naphtho[2,3-c]furan]-9'-carbaldehyde is a complex organic compound characterized by a unique spiro structure that incorporates both a naphthofuran ring and a dioxolane ring. This molecule is distinguished by the presence of an aldehyde group, which classifies it as a carbaldehyde, along with a ketone group and several methyl groups. Its intricate molecular architecture suggests potential applications across various fields, including organic chemistry, pharmaceuticals, and materials science. However, further research is essential to explore and confirm its full spectrum of uses and properties.

Uses

Used in Organic Chemistry:
(1'R,3a'R,4a'R,8a'R,9'R,9a'S)-1',8a'-dimethyl-3'-oxodecahydro-1'H-spiro[[1,3]dioxolane-2,6'-naphtho[2,3-c]furan]-9'-carbaldehyde serves as a valuable intermediate in the synthesis of more complex organic molecules due to its reactive functional groups and unique spiro structure.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, this compound may be utilized as a precursor for the development of novel drugs, given its potential to form a variety of chemical derivatives and its capacity to interact with biological targets due to its structural complexity.
Used in Materials Science:
(1'R,3a'R,4a'R,8a'R,9'R,9a'S)-1',8a'-dimethyl-3'-oxodecahydro-1'H-spiro[[1,3]dioxolane-2,6'-naphtho[2,3-c]furan]-9'-carbaldehyde could be employed in the design of new materials with specific properties, such as in the creation of advanced polymers or as part of molecular devices, owing to its versatile chemical structure.

Upstream product

• 226916-27-4 (1'R,3'aR,4'aR,8'aR,9'S,9'aS)-decahydro-1'-methyl-3'-oxo-spiro[1,3-dioxolane-2,6'(3'H)-naphtho[2,3-c]furan]-9'-carboxylic acid 
• 900180-04-3 C₁₆H₂₀O₆ 
• 226916-25-2 (1'R,3'aR,8'aS,9'S,9'aR)-1',3'a,5',7',8',8'a,9',9'a-octahydro-1'-methyl-3'-oxo-spiro[1,3-dioxolane-2,6'(3'H)-naphtho[2,3-c]furan]-9'-carboxylic acid phenylmethyl ester 

Downstream Products

• 226915-12-4 (1'R,3'aR,4'aR,8'aR,9'S,9'aS)-decahydro-1'-methyl-9'-[(E)-2-[5-[3-(trifluoromethyl)phenyl]-2-pyridinyl]ethenyl]-spiro[1,3-dioxolane-26'(3'H)-naphtho[2,3-c]furan]-3'-one 

Relevant articles and documents

Metabolism-based identification of a potent thrombin receptor antagonist

The metabolism of our prototypical thrombin receptor antagonist 1, K i = 2.7 nM, was studied and three major metabolites (2, 4, and 5) were found. The structures of the metabolites were verified independently by synthesis. Compound 4 was shown