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CHEBI:185008 - Tupichinol A

ChEBI IDCHEBI:185008
ChEBI NameTupichinol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H18O4
Net Charge0
Average Mass286.327
Monoisotopic Mass286.12051
SMILESCOc1ccc2c(c1C)O[C@H](c1ccc(O)cc1)[C@H](O)C2
InChIInChI=1S/C17H18O4/c1-10-15(20-2)8-5-12-9-14(19)17(21-16(10)12)11-3-6-13(18)7-4-11/h3-8,14,17-19H,9H2,1-2H3/t14-,17-/m1/s1
InChIKeyPSCVPMJLJOIQKC-RHSMWYFYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Tupichinol A (CHEBI:185008) is a ether (CHEBI:25698)
Tupichinol A (CHEBI:185008) is a flavonoids (CHEBI:72544)
IUPAC Name 
(2R,3R)-2-(4-hydroxyphenyl)-7-methoxy-8-methyl-3,4-dihydro-2H-chromen-3-ol
Manual XrefsDatabases
LMPK12020006LIPID MAPS
553462ChemSpider