Cas no 678138-59-5 (2,3,2",3"-Tetrahydroochnaflavone)

2,3,2,3-Tetrahydroochnaflavone is a flavonoid derivative characterized by its partially hydrogenated structure, which enhances stability and bioavailability compared to its non-hydrogenated counterparts. This compound exhibits potential pharmacological activity, including antioxidant and anti-inflammatory properties, making it of interest in medicinal chemistry and drug development. Its unique structural features, such as the tetrahydro modification, may improve solubility and metabolic resistance, facilitating in vitro and in vivo studies. Analytical methods such as HPLC and NMR confirm its high purity, ensuring reliability for research applications. Further investigations into its mechanism of action and therapeutic potential are ongoing, highlighting its relevance in bioactive compound research.
2,3,2",3"-Tetrahydroochnaflavone structure
678138-59-5 structure
Product Name:2,3,2",3"-Tetrahydroochnaflavone
CAS No:678138-59-5
MF:C30H22O10
MW:542.489689350128
CID:836997
PubChem ID:11478288
Update Time:2025-06-09

2,3,2",3"-Tetrahydroochnaflavone Chemical and Physical Properties

Names and Identifiers

    • 4H-1-Benzopyran-4-one, 2-[4-[5-(3,4-dihydro-5,7-dihydroxy-4-oxo-2H-1-benzopyran-2-yl)-2-hydro xyphenoxy]phenyl]-2,3-dihydro-5,7-dihydroxy-
    • 2,3,2",3"-Tetrahydroochnaflavone
    • (2S)-2-(4-{5-[(2S)-5,7-Dihydroxy-4-oxo-3,4-dihydro-2H-chromen-2-y l]-2-hydroxyphenoxy}phenyl)-5,7-dihydroxy-2,3-dihydro-4H-chromen- 4-one
    • 4H-1-Benzopyran-4-one, 2-[4-[5-(3,4-dihydro-5,7-dihydroxy-4-oxo-2H-1-benzopyran-2-yl)-2-hydro xyphenoxy]phenyl]-2,3-dihydro-5
    • 4H-1-Benzopyran-4-one,2-[4-[5-(3,4-dihydro-5,7-dihydroxy-4-oxo-2H-1-benzopyran-2-yl)-2-hydroxyphenoxy]phenyl]-2,3-dihydro-5,7-dihydroxy-
    • [ "" ]
    • AKOS032961741
    • 678138-59-5
    • 2,3,2'',3''-tetrahydroochnaflavone
    • FS-8952
    • 2,3,2',3'-Tetrahydroochnaflavone
    • CHEMBL465971
    • AKOS040758717
    • 2-[4-[5-(5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
    • DA-49245
    • Inchi: 1S/C30H22O10/c31-16-8-20(34)29-22(36)12-24(39-27(29)10-16)14-1-4-18(5-2-14)38-26-7-15(3-6-19(26)33)25-13-23(37)30-21(35)9-17(32)11-28(30)40-25/h1-11,24-25,31-35H,12-13H2
    • InChI Key: XEODGBSMXJKQNI-UHFFFAOYSA-N
    • SMILES: O1C2C=C(C=C(C=2C(CC1C1C=CC(=C(C=1)OC1C=CC(=CC=1)C1CC(C2C(=CC(=CC=2O1)O)O)=O)O)=O)O)O

Computed Properties

  • Exact Mass: 542.12100
  • Monoisotopic Mass: 542.12129689g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 40
  • Rotatable Bond Count: 4
  • Complexity: 920
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.7
  • Topological Polar Surface Area: 163?2

Experimental Properties

  • Color/Form: Yellow powder
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 854.6±65.0 °C at 760 mmHg
  • Flash Point: 287.7±27.8 °C
  • PSA: 162.98000
  • LogP: 5.41990
  • Vapor Pressure: 0.0±3.3 mmHg at 25°C

2,3,2",3"-Tetrahydroochnaflavone Security Information

2,3,2",3"-Tetrahydroochnaflavone Pricemore >>

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