4,7-dichlorounguinol (CHEBI:215577)

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CHEBI:215577 - 4,7-dichlorounguinol

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ChEBI ID	CHEBI:215577
ChEBI Name	4,7-dichlorounguinol
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C19H16Cl2O5
Net Charge	0
Average Mass	395.238
Monoisotopic Mass	394.03748
SMILES	C/C=C(\C)c1c(Cl)c(O)c(C)c2c1Oc1c(Cl)c(O)cc(C)c1C(=O)O2
InChI	InChI=1S/C19H16Cl2O5/c1-5-7(2)11-14(21)15(23)9(4)16-18(11)25-17-12(19(24)26-16)8(3)6-10(22)13(17)20/h5-6,22-23H,1-4H3/b7-5+
InChIKey	GXWHFDWAMBORIU-FNORWQNLSA-N

Species of Metabolite	Component	Source	Comments
Aspergillus unguis (ncbitaxon:40381)	-	PubMed (29634062)

ChEBI Ontology

Outgoing Relation(s)
	4,7-dichlorounguinol (CHEBI:215577) is a carbonyl compound (CHEBI:36586)

IUPAC Name
1-[(E)-but-2-en-2-yl]-2,10-dichloro-3,9-dihydroxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one