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CHEBI:187631 - Lophirone J

ChEBI IDCHEBI:187631
ChEBI NameLophirone J
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H20O5
Net Charge0
Average Mass400.430
Monoisotopic Mass400.13107
SMILESCOc1ccc(-c2cc3cc([C@@H]4CC(=O)c5ccc(OC)cc5O4)ccc3o2)cc1
InChIInChI=1S/C25H20O5/c1-27-18-6-3-15(4-7-18)23-12-17-11-16(5-10-22(17)29-23)24-14-21(26)20-9-8-19(28-2)13-25(20)30-24/h3-13,24H,14H2,1-2H3/t24-/m0/s1
InChIKeyGIIGHMRSPFEORX-DEOSSOPVSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Lophirone J (CHEBI:187631) is a benzofurans (CHEBI:35259)
IUPAC Name 
(2S)-7-methoxy-2-[2-(4-methoxyphenyl)-1-benzouran-5-yl]-2,3-dihydrochromen-4-one
Manual XrefsDatabases
24846235ChemSpider
LMPK12140049LIPID MAPS