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6,6′-Bieckol

6,6′-Bieckol structure

CAS No:
88095-81-2
Formula:
C36H22O18
Chemical Name:
6,6′-Bieckol
Synonyms:
[1,1′-Bidibenzo[b,e][1,4]dioxin]-2,2′,4,4′,7,7′,9,9′-octol,6,6′-bis(3,5-dihydroxyphenoxy)-;Dibenzo[b,e][1,4]dioxin,bimol. deriv.;6,6′-Bis(3,5-dihydroxyphenoxy)[1,1′-bidibenzo[b,e][1,4]dioxin]-2,2′,4,4′,7,7′,9,9′-octol;6,6′-Bieckol
Categories:
Organic Chemistry > Dioxins and Dioxin-like Compounds

Description

ChEBI: A phlorotanin that is 1,1'-bioxanthrene substituted by 3,5-dihydroxyphenoxy groups at position 6 and 6' and hydroxy groups at positions 2, 2', 4, 4', 7, 7', 9 and 9' respectively. It is isolated from an edible marine brown alga Ecklonia cava and exhibits antioxidant activity.

6,6'-bieckol is a phlorotanin that is 1,1'-bioxanthrene substituted by 3,5-dihydroxyphenoxy groups at position 6 and 6' and hydroxy groups at positions 2, 2', 4, 4', 7, 7', 9 and 9' respectively. It is isolated from an edible marine brown alga Ecklonia cava and exhibits antioxidant activity. It has a role as a metabolite, a radical scavenger and an anti-HIV-1 agent. It is a phlorotannin, an aromatic ether and an oxacycle. It derives from a phloroglucinol.

6,6′-Bieckol Basic Attributes

Molecular Weight：

742.54908

Exact Mass：

742.55

UNII：

87U82W6IFI

DSSTox ID：

DTXSID50236812

Characteristics

PSA：

298

XLogP3：

7.20140

Density：

1.882g/cm3

Melting Point：

>300 °C

Boiling Point：

1089.5ºC at 760 mmHg

Flash Point：

612.7ºC

Refractive Index：

1.865

Drug Information

MeSH Entry Terms：

6,6'-bieckol

Computed Properties

Molecular Weight:742.5
XLogP3:4.6
Hydrogen Bond Donor Count:12
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:5
Exact Mass:742.08061385
Monoisotopic Mass:742.08061385
Topological Polar Surface Area:298
Heavy Atom Count:54
Complexity:1170
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes