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CHEBI:186437 - Amoritin

ChEBI IDCHEBI:186437
ChEBI NameAmoritin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H38O6
Net Charge0
Average Mass506.639
Monoisotopic Mass506.26684
SMILESCOc1cc(C2CC(=O)c3c(O)c(CC=C(C)C)c(O)c(CC=C(C)C)c3O2)cc(CC=C(C)C)c1O
InChIInChI=1S/C31H38O6/c1-17(2)8-11-20-14-21(15-26(36-7)28(20)33)25-16-24(32)27-30(35)22(12-9-18(3)4)29(34)23(31(27)37-25)13-10-19(5)6/h8-10,14-15,25,33-35H,11-13,16H2,1-7H3
InChIKeyLBUIMKICYMGNNI-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)
Amoritin (CHEBI:186437) is a flavanones (CHEBI:28863)
IUPAC Name 
5,7-dihydroxy-2-[4-hydroxy-3-methoxy-5-(3-methylbut-2-enyl)phenyl]-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Manual XrefsDatabases
LMPK12140440LIPID MAPS
24846485ChemSpider