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CHEBI:171988 - Heterophyllin

ChEBI IDCHEBI:171988
ChEBI NameHeterophyllin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H32O7
Net Charge0
Average Mass504.579
Monoisotopic Mass504.21480
SMILESCC(C)=CCc1c(-c2cc(O)c(O)cc2O)oc2c(CC=C(C)C)c3c(c(O)c2c1=O)C=CC(C)(C)O3
InChIInChI=1S/C30H32O7/c1-15(2)7-9-17-25(34)24-26(35)18-11-12-30(5,6)37-28(18)19(10-8-16(3)4)29(24)36-27(17)20-13-22(32)23(33)14-21(20)31/h7-8,11-14,31-33,35H,9-10H2,1-6H3
InChIKeyCBYLXVCMCVXUQQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Heterophyllin (CHEBI:171988) is a flavones (CHEBI:24043)
IUPAC Name 
5-hydroxy-2,2-dimethyl-7,10-bis(3-methylbut-2-enyl)-8-(2,4,5-trihydroxyphenyl)pyrano[3,2-g]chromen-6-one
Manual XrefsDatabases
C09037KEGG COMPOUND
LMPK12110929LIPID MAPS
HMDB0034660HMDB
23339594ChemSpider