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CHEBI:188604 - cadiolide B

ChEBI IDCHEBI:188604
ChEBI Namecadiolide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H10Br6O6
Net Charge0
Average Mass873.762
Monoisotopic Mass867.55776
SMILESO=C1O/C(=C\c2cc(Br)c(O)c(Br)c2)C(c2cc(Br)c(O)c(Br)c2)=C1C(=O)c1cc(Br)c(O)c(Br)c1
InChIInChI=1S/C24H10Br6O6/c25-11-1-8(2-12(26)21(11)32)3-17-18(9-4-13(27)22(33)14(28)5-9)19(24(35)36-17)20(31)10-6-15(29)23(34)16(30)7-10/h1-7,32-34H/b17-3-
InChIKeyCJOZHMMQXWACBU-YPEHOIGNSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
cadiolide B (CHEBI:188604) has functional parent cinnamic acid (CHEBI:27386)
cadiolide B (CHEBI:188604) is a olefinic compound (CHEBI:78840)
IUPAC Name 
(5Z)-3-(3,5-dibromo-4-hydroxybenzoyl)-4-(3,5-dibromo-4-hydroxyphenyl)-5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]uran-2-one
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9575184ChemSpider