4'-Hydroxyflavanone - ≥98% , CAS No.6515-37-3

CAS: 6515-37-3 Cat. No.: H157179 Formule: C₁₅H₁₂O₃ Poids moléculaire: 240.26 Beilstein Registry Number: 18(3/4)637 Numéro CE: 676-790-1

GRADE & PURITY ≥98%

Synonyms

4''-Hydroxyflavanone | 4'-Hydroxyflavanone | 4'-Hydroxy-Flavanone | 4-hydroxyflavanone | 5K6L8O868Y | SMR001224351 | 2,3-Dihydro-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one | 4 inverted exclamation mark -Hydroxyflavanone | ACon1_000184 | CHEBI:34361 | DTXSI

Storage

Stocker à -20°C, chargé d'argon

Shipped In

Glacière + blocs de glace

Vue d’ensemble

Description du produit :

la 4'-Hydroxyflavanone est un inhibiteur de la maturation des SREBP et de la synthèse des lipides. la 4'-hydroxyflavanone est un analogue synthétique de la flavanone, qui présente un potentiel pour la recherche sur la stéatose hépatique et la dyslipidémie.

Application du produit :

la 4'-Hydroxyflavanone pourrait être un agent antitumoral utile, spécifiquement étudié comme un puissant inhibiteur de l'aromatase contre le cancer du sein dépendant des œstrogènes.

Specifications

Synonymes

4''-Hydroxyflavanone | 4'-Hydroxyflavanone | 4'-Hydroxy-Flavanone | 4-hydroxyflavanone | 5K6L8O868Y | SMR001224351 | 2,3-Dihydro-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one | 4 inverted exclamation mark -Hydroxyflavanone | ACon1_000184 | CHEBI:34361 | DTXSI

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Stocker à -20°C, chargé d'argon

Expédié en

Glacière + blocs de glace

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 488188388
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488188388
• Sourires canoniques: C1C(OC2=CC=CC=C2C1=O)C3=CC=C(C=C3)O
• IUPAC Name: 2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
• InChIKey: ZLHVIYHWWQYJID-UHFFFAOYSA-N
• INCHI: 1S/C15H12O3/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-8,15-16H,9H2
• Isomères SMILES: C1C(OC2=CC=CC=C2C1=O)C3=CC=C(C=C3)O
• Poids moléculaire: 240.26
• Beilstein: 18(3/4)637
• Reaxy-Rn: 384424
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=384424&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • Classe Flavonoids
      • Subclass Flavans

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Classe: Flavonoids
• Subclass: Flavans
• Intermediate Tree Nodes: Not available
• Direct Parent: Flavanones
• Alternative Parents: Monohydroxyflavonoids 4'-hydroxyflavonoids Chromones Aryl alkyl ketones Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Oxacyclic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 4'-hydroxyflavonoid - Monohydroxyflavonoid - Hydroxyflavonoid - Flavanone - Chromone - Chromane - Benzopyran - 1-benzopyran - Aryl alkyl ketone - Aryl ketone - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as flavanones. These are compounds containing a flavan-3-one moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran bearing a ketone at the carbon C3.
• External Descriptors: monohydroxyflavanone

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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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Chloroform (Slightly, Heated), Methanol (Slightly)
• Point de fusion (°C): 192 °C
• Poids moléculaire: 240.250 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 240.079 Da
• Monoisotopic Mass: 240.079 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 307.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1