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The chemical compound "2-[(2E,5E,7E,9R,10R,11E)-10-hydroxy-3,7,9,11-tetramethyl-trideca-2,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one" is a complex organic molecule with a unique structure. It features a pyridin-4-one core, which is a heterocyclic compound with a nitrogen atom in the ring. The molecule has a 10-hydroxy-3,7,9,11-tetramethyl-trideca-2,5,7,11-tetraenyl side chain, which is a long, unsaturated hydrocarbon chain with four methyl groups and a hydroxyl group. Additionally, it contains two methoxy groups attached to the pyridine ring, which are methanol (CH3OH) groups. 2-[(2E,5E,7E,9R,10R,11E)-10-hydroxy-3,7,9,11-tetramethyl-trideca-2,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one is characterized by its specific stereochemistry, with the R configuration at the 9 and 10 carbons, and the E configuration at the double bonds, indicating the trans arrangement of the substituents around the double bonds. The compound's structure and properties make it a potential candidate for various applications in chemistry and biology, though its specific uses or effects are not detailed in this summary.

5085-85-8

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5085-85-8 Usage

Explanation

This is the chemical name of the compound, also known as astaxanthin.

Explanation

Astaxanthin belongs to the carotenoid family, which are organic pigments found in plants, algae, and some bacteria.
3. Antioxidant activity

Explanation

Astaxanthin has the ability to neutralize free radicals, which can cause cellular damage and contribute to aging and various diseases.

Explanation

Astaxanthin is naturally found in these marine organisms, giving them their characteristic pink or red color.

Explanation

Astaxanthin has been shown to provide various health benefits, including reducing inflammation, preventing cancer, and protecting the skin from damage.

Explanation

Due to its health benefits and color, astaxanthin is used as a dietary supplement and as a natural food coloring agent in various products.

Explanation

Astaxanthin's antioxidant and anti-aging properties make it a promising candidate for use in pharmaceutical and cosmetic products.

Classification

Carotenoid compound

Natural sources

Marine organisms (microalgae, salmon, shrimp)

Health benefits

Anti-inflammatory, anti-cancer, and skin-protective properties

Uses

Dietary supplement, food coloring agent

Potential applications

Pharmaceutical and cosmetic industries

Check Digit Verification of cas no

The CAS Registry Mumber 5085-85-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,0,8 and 5 respectively; the second part has 2 digits, 8 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 5085-85:
(6*5)+(5*0)+(4*8)+(3*5)+(2*8)+(1*5)=98
98 % 10 = 8
So 5085-85-8 is a valid CAS Registry Number.
InChI:InChI=1/C25H37NO4/c1-9-18(4)22(27)19(5)15-17(3)12-10-11-16(2)13-14-21-20(6)23(28)24(29-7)25(26-21)30-8/h9-10,12-13,15,19,22,27H,11,14H2,1-8H3,(H,26,28)/b12-10+,16-13+,17-15+,18-9+/t19-,22+/m1/s1

5085-85-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(10-hydroxy-3,7,9,11-tetramethyltrideca-2,5,7,11-tetraenyl)-5,6-dimethoxy-3-methyl-1H-pyridin-4-one

1.2 Other means of identification

Product number -
Other names 2-[(2E,5E,7E,9R,10R,11E)-10-HYDROXY-3,7,9,11-TETRAMETHYL-TRIDECA-2,5,7,11-TETRAENYL]-5,6-DIMETHOXY-3-METHYL-1H-PYRIDIN-4-ONE

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:5085-85-8 SDS

5085-85-8Downstream Products

5085-85-8Relevant academic research and scientific papers

Propene as an Atom-Economical Linchpin for Concise Total Synthesis of Polyenes: Piericidin A

Trost, Barry M.,Gholami, Hadi

supporting information, p. 11623 - 11626 (2018/09/21)

A concise and convergent total synthesis of piericidin A is disclosed. The synthesis hinges on the utilization of propene as a synthetic linchpin to merge the properly elaborated alkyne fragments, leading to the 1,3,6-triene motif of piericidin A. Utilization of propene as a unique alkene, capable of sequential coupling with two alkynes, is further illustrated in the context of various 1,3,6-triene products. The latter process proceeds with high atom economy and efficiently gives rise to complex frameworks from readily accessible alkyne substrates. This strategic C-C bond formation offers an orthogonal paradigm in the design of synthetic routes, leading to higher step economy and more efficient syntheses of polyunsaturated natural products.

Polyketides and Anthranilic Acid Possessing 6-Deoxy-α- l -talopyranose from a Streptomyces Species

Son, Sangkeun,Ko, Sung-Kyun,Jang, Mina,Lee, Jae Kyoung,Kwon, Min Cheol,Kang, Dong Hyo,Ryoo, In-Ja,Lee, Jung-Sook,Hong, Young-Soo,Kim, Bo Yeon,Jang, Jae-Hyuk,Ahn, Jong Seog

, p. 1378 - 1386 (2017/05/31)

A bioassay-guided investigation in conjunction with chemical screening led to the isolation of three new glycosides, ulleungoside (1), 2-methylaminobenzoyl 6-deoxy-α-l-talopyranoside (2), and naphthomycinoside (3), along with three known secondary metabolites (5-7) from Streptomyces sp. KCB13F030. Their structures were elucidated by detailed NMR and MS spectroscopic analyses. Absolute configurational analysis of the sugar units based on the magnitudes of the coupling constants, NOESY correlations, chemical derivatization, and optical rotation measurements revealed that compounds 1-3 and 5 incorporate the rare deoxyhexose 6-deoxy-α-l-talopyranose. The absolute configuration of a polyketide extender unit of 3 was determined by applying the J-based configuration analysis and modified Mosher's method. Ulleungoside (1) and naphthomycin A (7) showed in vitro inhibitory effects against indoleamine 2,3-dioxygenase activity. Further bioevaluation revealed that compounds 1 and 7 had moderate antiproliferative activities against several cancer cell lines, and compounds 5 and 6, which are members of the piericidin family, induced autophagosome accumulation.

Total synthesis of (+)-piericidin A1 and (-)-piericidin B1

Kikuchi, Ryosuke,Fujii, Mikio,Akita, Hiroyuki

experimental part, p. 1975 - 1983 (2010/03/04)

The convergent syntheses of (+)-piericidin A1 1 and (-)-piericidin B1 2 have been achieved based on classical Julia-Lythgoe olefination between 4-hydroxy-5,6-dimethoxy-3-methyl-2-[5-oxo-3-methyl-pent-(2E)-enyl]-pyridine 3 correspondi

Total synthesis of piericidin A1 and B1 and key analogues

Schnermann, Martin J.,Romero, F. Anthony,Hwang, Inkyu,Nakamaru-Ogiso, Eiko,Yagi, Takao,Boger, Dale L.

, p. 11799 - 11807 (2007/10/03)

Full details of the total synthesis of piericidin A1 and B1 and its extension to the preparation of a series of key analogues are described including ent-piericidin A1 (ent-1), 4′-deshydroxypiericidin A1 (58), 5′-desmethylpiericidin A1 (73), 4′-deshydroxy-5′- desmethylpiericidin A1 (75), and the corresponding analogues 51, 59, 76, and 77 bearing a simplified farnesyl side chain. The evaluation of these key analogues, along with those derived from their further functionalizations, permitted a scan of the key structural features providing new insights into the role of the substituents found in both the pyridyl core as well as the side chain. A strategic late stage heterobenzylic Stille cross-coupling reaction of the pyridyl core with the fully elaborated side chain permitted ready access to the analogues in which each half of the molecule could be systematically and divergently modified. The pyridyl cores were assembled enlisting inverse electron demand Diels-Alder reactions of N-sulfonyl-1-azabutadienes, while key elements of side chain syntheses include an anti selective asymmetric aldol to install the C9 and C10 relative and absolute stereochemistry (for natural and ent-1) and a modified Julia olefination for formation of the C5-C6 trans double bond with convergent assemblage of the side chains.

Total synthesis of piericidin A1 and B1

Schnermann, Martin J.,Boger, Dale L.

, p. 15704 - 15705 (2007/10/03)

The first total syntheses of piericidin A1 and B1 are disclosed and unambiguously establish the relative and absolute stereochemistry of the natural products by an approach that will facilitate the synthesis of a series of analogues. Central to the approach is an inverse electron demand Diels-Alder reaction of a N-sulfonyl-1-aza-1,3-butadiene with tetramethoxyethene followed by Lewis acid-promoted aromatization used to assemble the functionalized pyridine core. Additional key elements in the convergent approach include the use of an anti-aldol reaction to install the C9 and C10 relative and absolute stereochemistry, a modified Julia olefination for formation of the C5-C6 trans double bond with convergent assemblage of the side chain, and a penultimate heterobenzylic Stille cross-coupling reaction of the pyridyl core with the fully elaborated side chain. Copyright

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