Myristicin - 10mM in DMSO , CAS No.607-91-0

CAS: 607-91-0 Cat. No.: M425033 Formula: C₁₁H₁₂O₃ Peso molecolare: 192.21 Beilstein Registry Number: 166218 Numero EC: 210-146-9

GRADE & PURITY 10mM in DMSO

Synonyms

CAS-607-91-0 | 4-Methoxy-6-[2-propenyl]-1,3-benzodioxole | HY-N2510 | NCGC00257726-01 | STK693140 | 04PD6CT78W | 1-Methoxy-2,3-methylenedioxy-5-(2-propenyl)benzene | SCHEMBL68041 | SR-01000838340 | Myristicin | NCGC00091427-02 | AC-34678 | MS-23038 | 4-Me

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

Sinonimi

CAS-607-91-0 | 4-Methoxy-6-[2-propenyl]-1,3-benzodioxole | HY-N2510 | NCGC00257726-01 | STK693140 | 04PD6CT78W | 1-Methoxy-2,3-methylenedioxy-5-(2-propenyl)benzene | SCHEMBL68041 | SR-01000838340 | Myristicin | NCGC00091427-02 | AC-34678 | MS-23038 | 4-Me

Specifiche e purezza

10mM in DMSO

Meccanismi biochimici e fisiologici

Glutathione S-transferase inducer. Inhibits LPS-induced TNF-α release. Shows chemopreventive, potent hepatoprotective and psychoactive effects in vivo. Blood-brain barrier permeable. Orally active.

Condizioni di conservazione di stoccaggio

Store at -80°C

Spedito in

Dry ice packs + Cold packs

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Nomi e identificatori

• Pubchem Sid: 528774927
• Sorrisi canonici: COC1=CC(=CC2=C1OCO2)CC=C
• IUPAC Name: 4-methoxy-6-prop-2-enyl-1,3-benzodioxole
• InChIKey: BNWJOHGLIBDBOB-UHFFFAOYSA-N
• INCHI: 1S/C11H12O3/c1-3-4-8-5-9(12-2)11-10(6-8)13-7-14-11/h3,5-6H,1,4,7H2,2H3
• Isomeri SMILES: COC1=CC(=CC2=C1OCO2)CC=C
• WGK Germania: 3
• RTECS: CY2625000
• Peso molecolare: 192.21
• Beilstein: 166218
• Reaxy-Rn: 166218
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=166218&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Benzodioxoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Benzodioxoles
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzodioxoles
• Alternative Parents: Anisoles Alkyl aryl ethers Oxacyclic compounds Acetals Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzodioxole - Anisole - Alkyl aryl ether - Benzenoid - Oxacycle - Ether - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
• External Descriptors: Monolignols

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Obiettivi associati (umani)

ACHE Tclin Acetylcholinesterase (18204 Activities)

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CCR3 Tchem C-C chemokine receptor type 3 (1666 Activities)

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ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

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CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

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POLI Tchem DNA polymerase iota (116820 Activities)

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SMN1 Tchem Survival motor neuron protein (34246 Activities)

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GMNN Tbio Geminin (128009 Activities)

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Obiettivi associati (non umani)

Ppard Peroxisome proliferator-activated receptor delta (358 Activities)

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MAL62 Alpha-glucosidase MAL62 (106 Activities)

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Nannizzia gypsea (2039 Activities)

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Microsporum canis (872 Activities)

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Aspergillus flavus (8875 Activities)

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Aspergillus niger (16508 Activities)

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Saccharomyces cerevisiae (19171 Activities)

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Aspergillus fumigatus (16427 Activities)

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Plasmodium falciparum (966862 Activities)

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Cryptococcus neoformans (21258 Activities)

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Candida albicans (78123 Activities)

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Trichophyton rubrum (3646 Activities)

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Aedes aegypti (630 Activities)

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Mus musculus (284745 Activities)

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Epidermophyton floccosum (561 Activities)

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RAW264.7 (28094 Activities)

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BCHE Cholinesterase (8742 Activities)

Discover Target: BCHE

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Cladosporium cucumerinum (320 Activities)

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Paracentrotus lividus (1138 Activities)

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Trichophyton mentagrophytes (4846 Activities)

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Peso molecolare: 192.210 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 192.079 Da
• Monoisotopic Mass: 192.079 Da
• Topological Polar Surface Area: 27.700 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 205.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Riferimenti

1. Lianfeng Luo, Jieqiong Wang, Meiqin Li, Yingbin Zhang, Yuwan Wang, Yongquan Xu, Haisheng Chen, Yan Zhu, Zhihui Feng, Junfeng Yin.  (2023)  Characterization of the key odorants and investigation of the effects of drying methods on the aroma, taste, color and volatile profiles of the fruit of Clausena anisum-olens (Blanco) Merr..  LWT-FOOD SCIENCE AND TECHNOLOGY,      [PMID:] [10.1016/j.lwt.2023.114476]