Ochnaflavone
Grundinformationen
- CAS
50276-96-5- Standard-SMILES
O=c1cc(-c2ccc(Oc3cc(-c4cc(=O)c5c(O)cc(O)cc5o4)ccc3O)cc2)oc2cc(O)cc(O)c12- InChIKey
NNPGECDACGBKDH-UHFFFAOYSA-N- Summenformel
- C30H18O10
- Durchschnittliche Molmasse
- 538,5 g/mol
- Monoisotopische Masse
- 538,08999677
Überblick
Ochnaflavone is a biflavonoid with an ether linkage between the B-rings of the apigenin and luteolin subunits. It has been isolated from several members of the Ochnaceae plant family. It has a role as an antibacterial agent, a leukotriene antagonist, an EC 3.1.1.4 (phospholipase A2) inhibitor, an antiatherogenic agent, an anti-inflammatory agent and a plant metabolite. It is a hydroxyflavone, an aromatic ether and a biflavonoid. It is functionally related to a luteolin and an apigenin.
Namen und Bezeichner
- Bevorzugter Name
- Ochnaflavone
- IUPAC
- 2-[4-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxychromen-4-one
- Englischer Name
- ochnaflavone
- Summenformel
- C30H18O10
- Molmasse
- 538.46
Namen und Synonyme
Ochnaflavone50276-96-52-[4-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxychromen-4-one5B97Q9UZ5TDTXSID701982814H-1-Benzopyran-4-one, 2-(4-(5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenoxy)phenyl)-5,7-dihydroxy-2-(4-(5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy)phenyl)-5,7-dihydroxychromen-4-one4H-1-Benzopyran-4-one, 2-[4-[5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxy-RefChem:167448DTXCID001207724H-1-Benzopyran-4-one, 2-04-05-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenoxy)phenyl)-5,7-dihydroxy-2-(4-(5-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenoxy)phenyl)-5,7-dihydroxy-4H-chromen-4-one
Weitere Namen anzeigen
OchinaflavoneSimilar to pyriloxanone -7-O- -d - glucopyranoside2-[4-[5-(5,7-Dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxy-4H-1-benzopyran-4-one
2-{4-[5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenoxy]phenyl}-5,7-dihydroxy-4H-chromen-4-oneochanaflavoneOchnaflavone7-O-beta-D-gluco-pyranosideUNII-5B97Q9UZ5Torb1681230SCHEMBL13829452CHEBI:194126ACA27696
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,3
- Polarare Oberfläche (TPSA)
- 163 Ų
- H-Brücken-Donoren
- 5
- H-Brücken-Akzeptoren
- 10
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 40
- Formalladung
- 0
- Komplexität
- 1.030
Physikochemische Eigenschaften
- Siedepunkt
- 832.1 · 832.1±65.0 °C(Predicted)
- Dichte
- 1.622 · 1.622
- storage temp.
- 2 · 2-8°C
- pka
- 6.49 · 6.49±0.40(Predicted)
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