3-Hydroxy-6-methoxyflavone - ≥98% , CAS No.93176-00-2

CAS: 93176-00-2 Cat. No.: H157354 Formula: C₁₆H₁₂O₄ Peso molecolare: 268.27 Numero EC: 677-383-1

GRADE & PURITY ≥98%

Synonyms

AKOS025146309 | FT-0642237 | ACon1_000011 | BRD-K90139951-001-01-9 | H1522 | AR-683/43306460 | DTXSID10350947 | MFCD00017639 | T73078 | 3-hydroxy-6-methoxy-2-phenyl-4H-chromen-4-one | 3-Hydroxy-6-methoxyflavanone | OGURJSOPVFCIOO-UHFFFAOYSA-N | 3-Hydroxy-

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinonimi

AKOS025146309 | FT-0642237 | ACon1_000011 | BRD-K90139951-001-01-9 | H1522 | AR-683/43306460 | DTXSID10350947 | MFCD00017639 | T73078 | 3-hydroxy-6-methoxy-2-phenyl-4H-chromen-4-one | 3-Hydroxy-6-methoxyflavanone | OGURJSOPVFCIOO-UHFFFAOYSA-N | 3-Hydroxy-

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Store at 2-8°C

Spedito in

Wet ice

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

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

504759894

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504759894

Sorrisi canonici

COC1=CC2=C(C=C1)OC(=C(C2=O)O)C3=CC=CC=C3

IUPAC Name

3-hydroxy-6-methoxy-2-phenylchromen-4-one

InChIKey

OGURJSOPVFCIOO-UHFFFAOYSA-N

INCHI

1S/C16H12O4/c1-19-11-7-8-13-12(9-11)14(17)15(18)16(20-13)10-5-3-2-4-6-10/h2-9,18H,1H3

Isomeri SMILES

COC1=CC2=C(C=C1)OC(=C(C2=O)O)C3=CC=CC=C3

Peso molecolare

268.27

Reaxy-Rn

241520

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=241520&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Classe: Flavonoids
• Subclass: Flavones
• Intermediate Tree Nodes: Not available
• Direct Parent: Flavonols
• Alternative Parents: 6-O-methylated flavonoids 3-hydroxyflavonoids Chromones Anisoles Pyranones and derivatives Alkyl aryl ethers Benzene and substituted derivatives Heteroaromatic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 6-methoxyflavonoid-skeleton - 3-hydroxyflavone - 3-hydroxyflavonoid - Hydroxyflavonoid - Chromone - 1-benzopyran - Benzopyran - Anisole - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as flavonols. These are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position.
• External Descriptors: Not available

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)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

AR Tclin Androgen Receptor (11781 Activities)

Discover Target: AR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in Dimethylformamide
• Punto di fusione (°C): 208 °C
• Peso molecolare: 268.260 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 268.074 Da
• Monoisotopic Mass: 268.074 Da
• Topological Polar Surface Area: 55.800 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 409.000
• 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

Domande frequenti

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 93176-00-2, the molecular formula is C16H12O4, and the molecular weight is 268.27 g/mol. InChIKey OGURJSOPVFCIOO-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.