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CHEBI:73097 - mallotophilippen E

ChEBI IDCHEBI:73097
ChEBI Namemallotophilippen E
Stars
DefinitionA member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 3, 4, 2' and 4', a prenyl group at position 3' and a 6-methyl-6-(4-methylpent-3-en-1-yl)-3,6-dihydro-2H-pyran ring fused across positions 5' and 6'
Last Modified14 April 2015
Submitternamrata
DownloadsMolfile
FormulaC30H34O6
Net Charge0
Average Mass490.596
Monoisotopic Mass490.23554
SMILESCC(C)=CCCC1(C)C=Cc2c(O)c(CC=C(C)C)c(O)c(C(=O)/C=C/c3ccc(O)c(O)c3)c2O1
InChIInChI=1S/C30H34O6/c1-18(2)7-6-15-30(5)16-14-22-27(34)21(11-8-19(3)4)28(35)26(29(22)36-30)24(32)13-10-20-9-12-23(31)25(33)17-20/h7-10,12-14,16-17,31,33-35H,6,11,15H2,1-5H3/b13-10+
InChIKeySEHURCMYIALHJN-JLHYYAGUSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
mallotophilippen E (CHEBI:73097) has role plant metabolite (CHEBI:76924)
mallotophilippen E (CHEBI:73097) is a chalcones (CHEBI:23086)
mallotophilippen E (CHEBI:73097) is a chromenol (CHEBI:39436)
mallotophilippen E (CHEBI:73097) is a polyphenol (CHEBI:26195)
Incoming Relation(s)
(R)-mallotophilippen E (CHEBI:73099) is a mallotophilippen E (CHEBI:73097)
(S)-mallotophilippen E (CHEBI:73098) is a mallotophilippen E (CHEBI:73097)
IUPAC Name 
(2E)-1-[5,7-dihydroxy-2-methyl-6-(3-methylbut-2-en-1-yl)-2-(4-methylpent-3-en-1-yl)-2H-chromen-8-yl]-3-(3,4-dihydroxyphenyl)prop-2-en-1-one
Manual XrefsDatabases
C00031999KNApSAcK
Citations