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CHEBI:184709 - Isoamoritin

ChEBI IDCHEBI:184709
ChEBI NameIsoamoritin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H38O6
Net Charge0
Average Mass506.639
Monoisotopic Mass506.26684
SMILESCOc1c(O)cc([C@@H]2CC(=O)c3c(O)c(CC=C(C)C)c(O)c(CC=C(C)C)c3O2)cc1CC=C(C)C
InChIInChI=1S/C31H38O6/c1-17(2)8-11-20-14-21(15-25(33)30(20)36-7)26-16-24(32)27-29(35)22(12-9-18(3)4)28(34)23(31(27)37-26)13-10-19(5)6/h8-10,14-15,26,33-35H,11-13,16H2,1-7H3/t26-/m0/s1
InChIKeyYSSBXXIEFDCVDX-SANMLTNESA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Isoamoritin (CHEBI:184709) is a flavanones (CHEBI:28863)
IUPAC Name 
(2S)-5,7-dihydroxy-2-[3-hydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Manual XrefsDatabases
24846456ChemSpider
LMPK12140384LIPID MAPS