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4-Oxoadamantane-1-carboxylic acid methyl ester is a chemical compound with the molecular formula C12H18O3, derived from the naturally occurring adamantane molecule. It is a white crystalline solid that is soluble in organic solvents and is commonly used as an intermediate in the synthesis of pharmaceutical substances and agrochemicals. Known for its use as a building block in the preparation of various derivatives and analogs for biological and medicinal research, 4-Oxoadamantane-1-carboxylic acid methyl ester holds potential applications in the pharmaceutical industry, specifically in the development of new drugs and therapeutic agents.

56674-88-5

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56674-88-5 Usage

Uses

Used in Pharmaceutical Industry:
4-Oxoadamantane-1-carboxylic acid methyl ester is used as an intermediate in the synthesis of pharmaceutical substances for its ability to be a building block in the preparation of various derivatives and analogs. This allows for the development of new drugs and therapeutic agents that can address a range of medical conditions.
Used in Agrochemicals:
In the agrochemical industry, 4-Oxoadamantane-1-carboxylic acid methyl ester is utilized as an intermediate in the synthesis of various agrochemicals, contributing to the development of effective products for agricultural applications.
Used in Biological and Medicinal Research:
4-Oxoadamantane-1-carboxylic acid methyl ester serves as a valuable building block in biological and medicinal research, enabling the creation of new compounds with potential therapeutic properties. Its versatility in chemical synthesis makes it a key component in exploring novel treatments and understanding biological mechanisms.

Check Digit Verification of cas no

The CAS Registry Mumber 56674-88-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,6,6,7 and 4 respectively; the second part has 2 digits, 8 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 56674-88:
(7*5)+(6*6)+(5*6)+(4*7)+(3*4)+(2*8)+(1*8)=165
165 % 10 = 5
So 56674-88-5 is a valid CAS Registry Number.
InChI:InChI=1S/C12H16O3/c1-15-11(14)12-4-7-2-8(5-12)10(13)9(3-7)6-12/h7-9H,2-6H2,1H3

56674-88-5SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl 4-oxoadamantane-1-carboxylate

1.2 Other means of identification

Product number -
Other names 2-adamantanone-5-carboxylic acid methyl ester

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:56674-88-5 SDS

56674-88-5Relevant academic research and scientific papers

Adamantane 11-β-HSD-1 inhibitors: Application of an isocyanide multicomponent reaction

Sorensen, Bryan,Rohde, Jeff,Wang, Jiahong,Fung, Steven,Monzon, Katina,Chiou, William,Pan, Liping,Deng, Xiaoqing,Stolarik, DeAnne,Frevert, Ernst U.,Jacobson, Peer,Link

, p. 5958 - 5962 (2006)

A series of potent and selective adamantane aminoamide 11-β-HSD-1 inhibitors has been optimized. Chemically these studies were expedited by utilizing readily obtained amino acids as starting materials or an isocyanide multicomponent reaction. Structure-ac

A Robust Au?C≡C Functionalized Surface: Toward Real-Time Mapping and Accurate Quantification of Fe2+ in the Brains of Live AD Mouse Models

Liao, Fumin,Liu, Zhichao,Tian, Yang,Wan, Jingjing,Zhang, Chuanping,Zhang, Limin,Zhou, Jian,Zhu, Anwei

, p. 20499 - 20507 (2020)

Described here is that Au?C≡C bonds showed the highest stability under biological conditions, with abundant thiols, and the best electrochemical performance compared to Au?S and Au?Se bonds. The new finding was also confirmed by theorical calculations. Based on this finding, a specific molecule for recognition of Fe2+ was designed and synthesized, and used to create a selective and accurate electrochemical sensor for the quantification of Fe2+. The present ratiometric strategy demonstrates high spatial resolution for real-time tracking of Fe2+ in a dynamic range of 0.2–120 μM. Finally, a microelectrode array with good biocompatibility was applied in imaging and biosensing of Fe2+ in the different regions of live mouse brains. Using this tool, it was discovered that the uptake of extracellular Fe2+ into the cortex and striatum was largely mediated by cyclic adenosine monophosphate (cAMP) through the CREB-related pathway in the brain of a mouse with Alzheimer's disease.

TRIOXOLANE AGENTS

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Paragraph 0425; 0426, (2019/01/16)

Disclosed herein, inter alia, are trioxolane compounds and methods of using the same for treatment and detection of diseases.

Activity-based protein profiling reveals that secondary-carbon-centered radicals of synthetic 1,2,4-trioxolanes are predominately responsible for modification of protein targets in malaria parasites

Wei, Chunyan,Zhao, Cheng-Xiao,Liu, Sheng,Zhao, Jin-Hui,Ye, Zi,Wang, Heng,Yu, Shi-Shan,Zhang, Chong-Jing

, p. 9535 - 9538 (2019/08/15)

Endoperoxide-containing antimalarials, such as artemisinin and the synthetic trioxolane OZ439, are prodrugs activated by heme to generate primary and secondary carbon-centered radicals. We employed activity-based protein profiling (ABPP) to show that the

CARBOXYLATE, CARBOXYLIC ACID GENERATOR, RESIST COMPOSITION, AND METHOD FOR PRODUCING RESIST PATTERN

-

Paragraph 0213, (2018/09/30)

PROBLEM TO BE SOLVED: To provide a salt and a resist composition capable of producing a resist pattern having a good mask error factor. SOLUTION: A carboxylate represented by formula (I), an acid generator containing the carboxylate, and a resist composition containing the acid generator are provided. [In the formula, Xa and Xb each independently represent an oxygen atom or a sulfur atom; X1 represents a hydrocarbon group which may have a substituent; L1 and L2 each independently represent a single bond or a hydrocarbon group which may have a substituent; R1 and R2 each independently represent an alicyclic hydrocarbon group which may have a substituent; -CH2- contained in the hydrocarbon groups and the alicyclic hydrocarbon group may be substituted with -O-, -S-, -CO-, or -S(O)2-; and Z1+ represents an organic cation.] SELECTED DRAWING: None COPYRIGHT: (C)2018,JPOandINPIT

A click chemistry-based proteomic approach reveals that 1,2,4-trioxolane and artemisinin antimalarials share a common protein alkylation profile

Ismail, Hanafy M.,Barton, Victoria E.,Panchana, Matthew,Charoensutthivarakul, Sitthivut,Biagini, Giancarlo A.,Ward, Stephen A.,O'Neill, Paul M.

supporting information, p. 6401 - 6405 (2016/06/01)

In spite of the recent increase in endoperoxide antimalarials under development, it remains unclear if all these chemotypes share a common mechanism of action. This is important since it will influence cross-resistance risks between the different classes. Here we investigate this proposition using novel clickable 1,2,4-trioxolane activity based protein-profiling probes (ABPPs). ABPPs with potent antimalarial activity were able to alkylate protein target(s) within the asexual erythrocytic stage of Plasmodium falciparum (3D7). Importantly, comparison of the alkylation fingerprint with that generated from an artemisinin ABPP equivalent confirms a highly conserved alkylation profile, with both endoperoxide classes targeting proteins in the glycolytic, hemoglobin degradation, antioxidant defence, protein synthesis and protein stress pathways, essential biological processes for plasmodial survival. The alkylation signatures of the two chemotypes show significant overlap (ca. 90 %) both qualitatively and semi-quantitatively, suggesting a common mechanism of action that raises concerns about potential cross-resistance liabilities. Clickable 1,2,4-trioxolane activity-based protein-profiling probes (ABPPs) were designed to retain antimalarial activity and alkylate the molecular targets of the blood stage of Plasmodium falciparum in situ. Comparison of the 1,2,4-trioxolane protein alkylation signature with the corresponding artemisinin ABPPs indicates that both drug classes target key proteins in the glycolytic, hemoglobin degradation, antioxidant defence and protein synthesis pathways.

NOVEL COMPOUND HAVING ABILITY TO INHIBIT 11B-HSD1 ENZYME OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, METHOD FOR PRODUCING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT

-

Paragraph 0065; 0066, (2015/05/06)

The present invention relates to a novel compound or a pharmaceutically acceptable salt thereof inhibiting 11β-HSD1 enzyme activity, a preparation method of the same, and a pharmaceutical composition comprising the same as an active ingredient. Since the compound of the present invention selectively inhibits the activity of 11β-HSD1 (11β-Hydroxysteroid dehydrogenase type 1), the compound of the invention can be effectively used as a therapeutic agent for the treatment of diseases caused by the over-activation of 11β-HSD1 such as non-insulin dependent type II diabetes, insulin resistance, obesity, lipid disorder, metabolic syndrome, and other diseases or condition mediated by the excessive activity of glucocorticoid.

ATX MODULATING AGENTS

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Page/Page column 173, (2015/12/24)

Compounds of formula (I) can modulate the activity of autotaxin (ATX).

NOVEL COMPOUND HAVING ABILITY TO INHIBIT 11B-HSD1 ENZYME OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, METHOD FOR PRODUCING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT

-

Paragraph 0424-0426, (2015/08/04)

The present invention relates to a novel compound or a pharmaceutically acceptable salt thereof inhibiting 11β-HSD1 enzyme activity, a preparation method of the same, and a pharmaceutical composition comprising the same as an active ingredient. Since the compound of the present invention selectively inhibits the activity of 11β-HSD1 (11β-Hydroxysteroid dehydrogenase type 1), the compound of the invention can be effectively used as a therapeutic agent for the treatment of diseases caused by the over-activation of 11β-HSD1 such as non-insulin dependent type II diabetes, insulin resistance, obesity, lipid disorder, metabolic syndrome, and other diseases or condition mediated by the excessive activity of glucocorticoid.

Selective trioxolane based bifunctional molecular linkers for covalent heme surface functionalisation

McConville,Bradley,Zhou,Schiffrin,O'Neil

, p. 186 - 188 (2014/01/06)

A bifunctional molecular linker containing both aryl diazonium and trioxolane groups was synthesised and its ability to sequentially functionalise glassy carbon and covalently immobilise heme investigated. Functionalisation was demonstrated by electrochemical techniques.

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