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CHEBI:184362 - 2-[2,3-dihydroxy-4,6-dimethoxy-5-(3-methylbut-2-en-1-yl)phenyl]-7-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one

ChEBI IDCHEBI:184362
ChEBI Name2-[2,3-dihydroxy-4,6-dimethoxy-5-(3-methylbut-2-en-1-yl)phenyl]-7-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H24O7
Net Charge0
Average Mass400.427
Monoisotopic Mass400.15220
SMILESCOc1c(O)c(O)c(C2CC(=O)c3ccc(O)cc3O2)c(OC)c1CC=C(C)C
InChIInChI=1S/C22H24O7/c1-11(2)5-7-14-21(27-3)18(19(25)20(26)22(14)28-4)17-10-15(24)13-8-6-12(23)9-16(13)29-17/h5-6,8-9,17,23,25-26H,7,10H2,1-4H3
InChIKeyPHLMXOBNNZKOMG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913)
spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein-Friesian cattle [26105007]
spermatozoon (FMA:67338) MetaboLights (MTBLS1071) Strain: Holstein-Friesian cattle [26105007]
ChEBI Ontology
Outgoing Relation(s)
2-[2,3-dihydroxy-4,6-dimethoxy-5-(3-methylbut-2-en-1-yl)phenyl]-7-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one (CHEBI:184362) is a flavanones (CHEBI:28863)
IUPAC Name 
2-[2,3-dihydroxy-4,6-dimethoxy-5-(3-methylbut-2-enyl)phenyl]-7-hydroxy-2,3-dihydrochromen-4-one
Manual XrefsDatabases
HMDB0124790HMDB
74851499ChemSpider