CHEBI:206865 - 2-Chlorounguinol

ChEBI IDCHEBI:206865
ChEBI Name2-Chlorounguinol
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SubmitterMetaboLights
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FormulaC19H17ClO5
Net Charge0
Average Mass360.793
Monoisotopic Mass360.07645
SMILESC/C=C(/C)c1cc(O)c(C)c2c1Oc1cc(O)c(Cl)c(C)c1C(=O)O2
InChIInChI=1S/C19H17ClO5/c1-5-8(2)11-6-12(21)9(3)17-18(11)24-14-7-13(22)16(20)10(4)15(14)19(23)25-17/h5-7,21-22H,1-4H3/b8-5-
InChIKeyKZPINWADEGOBQG-YVMONPNESA-N
Species of MetaboliteComponentSourceComments
Aspergillus unguis (ncbitaxon:40381) - DOI (10.1248/cpb.36.1970)
ChEBI Ontology
Outgoing Relation(s)
2-Chlorounguinol (CHEBI:206865) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
1-[(Z)-but-2-en-2-yl]-8-chloro-3,9-dihydroxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one
Manual XrefsDatabases
4978437ChemSpider