6,6'-bieckol (CHEBI:65496)

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CHEBI:65496 - 6,6'-bieckol

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ChEBI ID	CHEBI:65496
ChEBI Name	6,6'-bieckol
Stars
Definition	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.
Last Modified	28 January 2013
Downloads	Molfile

Formula	C36H22O18
Net Charge	0
Average Mass	742.554
Monoisotopic Mass	742.08061
SMILES	Oc1cc(O)cc(Oc2c(O)cc(O)c3c2Oc2c(O)cc(O)c(-c4c(O)cc(O)c5c4Oc4c(O)cc(O)c(Oc6cc(O)cc(O)c6)c4O5)c2O3)c1
InChI	InChI=1S/C36H22O18/c37-11-1-12(38)4-15(3-11)49-29-21(45)9-23(47)31-35(29)53-27-19(43)7-17(41)25(33(27)51-31)26-18(42)8-20(44)28-34(26)52-32-24(48)10-22(46)30(36(32)54-28)50-16-5-13(39)2-14(40)6-16/h1-10,37-48H
InChIKey	HBJNTPFHQKXWOY-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Ecklonia cava (ncbitaxon:105407)	-	PubMed (19201199)

Roles Classification

Chemical Role:	radical scavenger A role played by a substance that can react readily with, and thereby eliminate, radicals.
Biological Roles:	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. anti-HIV-1 agent An anti-HIV agent that destroys or inhibits the replication of HIV-1, the more infective and more virulent of the two types of HIV virus. algal metabolite Any eukaryotic metabolite produced during a metabolic reaction in algae including unicellular organisms like chlorella and diatoms to multicellular organisms like giant kelps and brown algae.
Applications:	astringent A compound that causes the contraction of body tissues, typically used to reduce bleeding from minor abrasions. astringent A compound that causes the contraction of body tissues, typically used to reduce bleeding from minor abrasions.

ChEBI Ontology

Outgoing Relation(s)
	6,6'-bieckol (CHEBI:65496) has functional parent phloroglucinol (CHEBI:16204)
	6,6'-bieckol (CHEBI:65496) has role anti-HIV-1 agent (CHEBI:64947)
	6,6'-bieckol (CHEBI:65496) has role metabolite (CHEBI:25212)
	6,6'-bieckol (CHEBI:65496) has role radical scavenger (CHEBI:48578)
	6,6'-bieckol (CHEBI:65496) is a aromatic ether (CHEBI:35618)
	6,6'-bieckol (CHEBI:65496) is a oxacycle (CHEBI:38104)
	6,6'-bieckol (CHEBI:65496) is a phlorotannin (CHEBI:71222)

IUPAC Name
6,6'-bis(3,5-dihydroxyphenoxy)-1,1'-bioxanthrene-2,2',4,4',7,7',9,9'-octol

Synonyms	Source
4-(3,5-dihydroxyphenoxy)-9-[6-(3,5-dihydroxyphenoxy)-2,4,7,9-tetrahydroxyoxanthren-1-yl]oxanthrene-1,3,6,8-tetrol	ChEBI
6,6'-bis(3,5-dihydroxyphenoxy)-(1,1'-bidibenzo[b,e][1,4]dioxin)-2,2',4,4',7,7',9,9'-octol	ChemIDplus

Registry Numbers	Sources
Reaxys:5713463	Reaxys
CAS:88095-81-2	ChemIDplus

Citations