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CHEBI:186134 - Calomelanol I

ChEBI IDCHEBI:186134
ChEBI NameCalomelanol I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H18O6
Net Charge0
Average Mass402.402
Monoisotopic Mass402.11034
SMILESO=C1CC(c2ccc(O)cc2)c2c(cc3c(c2O)C(=O)CC(c2ccccc2)O3)O1
InChIInChI=1S/C24H18O6/c25-15-8-6-13(7-9-15)16-10-21(27)30-19-12-20-23(24(28)22(16)19)17(26)11-18(29-20)14-4-2-1-3-5-14/h1-9,12,16,18,25,28H,10-11H2
InChIKeyZDCISPDGWCQAIP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Calomelanol I (CHEBI:186134) is a extended flavonoid (CHEBI:71037)
IUPAC Name 
5-hydroxy-4-(4-hydroxyphenyl)-8-phenyl-3,4,7,8-tetrahydropyrano[3,2-g]chromene-2,6-dione
Manual XrefsDatabases
24846329ChemSpider
LMPK12140204LIPID MAPS