Negletein - Moligand™,≥99% , CAS No.29550-13-8

CAS: 29550-13-8 Cat. No.: N650979 Summenformel: C₁₆H₁₂O₅ Molekulargewicht: 284.26 EG-Nummer: 802-126-9

GRADE & PURITY Moligand™, ≥99%

Synonyms

NCGC00385058-01!5,6-dihydroxy-7-methoxy-2-phenylchromen-4-one | ST055981 | AKOS024282370 | BCP33551 | CHEBI:190121 | 7-methoxy-5,6-bis(oxidanyl)-2-phenyl-chromen-4-one | HY-N4285 | 5,6-Dihydroxy-7-methoxy-2-phenyl-chromen-4-one | 5,6-dihydroxy-7-methoxy-2

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Übersicht

Negletein (5,6-Dihydroxy-7-methoxyflavone) is a flavone found in Scutellaria. Negletein shows anti-inflammatory activity via inhibiting TNF-α and IL-1β with IC50 values of 16.4 and 6.4 μM, respectively. Negletein can activate Nrf2 and inhibit ROS production. Negletein can enhance the neuroprotective effect of nerve growth factor. Negletein can inhibit amyloid beta-peptide release and accumulation. Negletein can inhibit pathogens biofilms formation. Negletein can be used for the researches of cancer, infection, inflammation and neurological disease, such as colon cancer and Alzheimer's disease.

Specifications

Synonyme

NCGC00385058-01!5,6-dihydroxy-7-methoxy-2-phenylchromen-4-one | ST055981 | AKOS024282370 | BCP33551 | CHEBI:190121 | 7-methoxy-5,6-bis(oxidanyl)-2-phenyl-chromen-4-one | HY-N4285 | 5,6-Dihydroxy-7-methoxy-2-phenyl-chromen-4-one | 5,6-dihydroxy-7-methoxy-2

Spezifikationen & Reinheit

Moligand™,≥99%

Storage

Store at 2-8°C,Protected from light,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Note

Moligand™

Aktionsart

INHIBITOR

Reinheit

≥99%

Namen und Kennungen

• Kanonisches Lächeln: COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=CC=C3)O)O
• IUPAC Name: 5,6-dihydroxy-7-methoxy-2-phenylchromen-4-one
• InChIKey: ZTHLHHDJRXJGRX-UHFFFAOYSA-N
• INCHI: 1S/C16H12O5/c1-20-13-8-12-14(16(19)15(13)18)10(17)7-11(21-12)9-5-3-2-4-6-9/h2-8,18-19H,1H3
• Isomere SMILES: COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=CC=C3)O)O
• Molekulargewicht: 284.26

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • Klasse Flavonoids
      • Subclass O-methylated flavonoids

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Klasse: Flavonoids
• Subclass: O-methylated flavonoids
• Intermediate Tree Nodes: Not available
• Direct Parent: 7-O-methylated flavonoids
• Alternative Parents: Flavones 6-hydroxyflavonoids 5-hydroxyflavonoids Chromones Anisoles Pyranones and derivatives Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids Benzene and substituted derivatives Vinylogous acids Heteroaromatic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 7-methoxyflavonoid-skeleton - 5-hydroxyflavonoid - 6-hydroxyflavonoid - Flavone - Hydroxyflavonoid - Chromone - Benzopyran - 1-benzopyran - Anisole - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Pyranone - Benzenoid - Pyran - Monocyclic benzene moiety - Vinylogous acid - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Ether - Organic oxide - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as 7-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone.
• External Descriptors: Flavones and Flavonols

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

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TOP2B Tclin DNA topoisomerase II beta (959 Activities)

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HT-29 (80576 Activities)

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SW480 (6023 Activities)

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H9 (1832 Activities)

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HepG2 (196354 Activities)

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Salmonella typhimurium (15756 Activities)

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Staphylococcus aureus (210822 Activities)

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Staphylococcus epidermidis (22802 Activities)

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Escherichia coli (133304 Activities)

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Stenotrophomonas maltophilia (1743 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: DMSO : 100 mg/mL (351.79 mM; Need ultrasonic)
• Empfindlichkeit: light sensitive；Moisture sensitive
• Schmelzpunkt (°C): 218-220°C
• Molekulargewicht: 284.260 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 284.068 Da
• Monoisotopic Mass: 284.068 Da
• Topological Polar Surface Area: 76.000 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 426.000
• 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