Urceolatin (CHEBI:66344)

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ChEBI Name	Urceolatin

ChEBI ID	CHEBI:66344

Definition	A natural product found in Polysiphonia urceolata.

Stars	This entity has been manually annotated by a third party.

Supplier Information

Download	Molfile XML SDF

Formula

C21H12Br2O6

Net Charge

Average Mass

520.12400

Monoisotopic Mass

517.90006

InChI

InChI=1S/C21H12Br2O6/c22-11-4-7(5-13(24)17(11)26)3-10-9-2-1-8-6-12(23)18(27)20-14(8)15(9)21(29-20)19(28)16(10)25/h1-2,4-6,24-28H,3H2

InChIKey

MUCAQKAQNJJHBH-UHFFFAOYSA-N

SMILES

Oc1cc(Cc2c(O)c(O)c3oc4c(O)c(Br)cc5ccc2c3c45)cc(Br)c1O

Metabolite of Species	Details
Polysiphonia urceolata (NCBI:txid65404)	See: PubMed

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means. (via phenanthrenes )

ChEBI Ontology
Outgoing	Urceolatin (CHEBI:66344) has role metabolite (CHEBI:25212) Urceolatin (CHEBI:66344) is a phenanthrol (CHEBI:25962)

Synonym	Source
6-Bromo-1-(3-bromo-4,5-dihydroxybenzyl)phenanthro[4,5-bcd]furan-2,3,5-triol	ChEBI

Citation	Type	Source
18324823	PubMed citation	Europe PMC

Last Modified

22 September 2014

General Comment
2014-10-17	Suggested Classification: ISA:dibenzofurans(CHEBI:38922); ISA:naphthols(CHEBI:25392); ISA:catechols(CHEBI:33566); ISA:bromophenol(CHEBI:33624); ISA:organobromine compound(CHEBI:37141); ISA:furans(CHEBI:24129); ISA:polyol(CHEBI:26191); ISA:aromatic alcohol(CHEBI:33854);