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CHEBI:193263 - Pyranochromene

ChEBI IDCHEBI:193263
ChEBI NamePyranochromene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O7
Net Charge0
Average Mass360.362
Monoisotopic Mass360.12090
SMILESC[C@H]1C[C@H](O)Oc2cc(O)c3c(c21)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C3
InChIInChI=1S/C19H20O7/c1-8-4-16(24)25-15-7-12(21)10-6-14(23)18(26-19(10)17(8)15)9-2-3-11(20)13(22)5-9/h2-3,5,7-8,14,16,18,20-24H,4,6H2,1H3/t8-,14+,16+,18+/m0/s1
InChIKeyKLFQXCVGEVYPOF-PCPPRTPOSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
Pyranochromene (CHEBI:193263) is a catechin (CHEBI:23053)
IUPAC Name 
(2R,3R,8R,10S)-2-(3,4-dihydroxyphenyl)-10-methyl-2,3,4,8,9,10-hexahydropyrano[2,3-]chromene-3,5,8-triol
Manual XrefsDatabases
24842555ChemSpider
LMPK12020088LIPID MAPS