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CHEBI:176661 - 1,7-bis(3,5-diethyl-4-hydroxyphenyl)-1,6-heptadiene-3,5-dione

ChEBI IDCHEBI:176661
ChEBI Name1,7-bis(3,5-diethyl-4-hydroxyphenyl)-1,6-heptadiene-3,5-dione
Stars
Last Modified6 August 2021
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H32O4
Net Charge0
Average Mass420.549
Monoisotopic Mass420.23006
SMILESCCc1cc(C=CC(=O)CC(=O)C=Cc2cc(CC)c(O)c(CC)c2)cc(CC)c1O
InChIInChI=1S/C27H32O4/c1-5-20-13-18(14-21(6-2)26(20)30)9-11-24(28)17-25(29)12-10-19-15-22(7-3)27(31)23(8-4)16-19/h9-16,30-31H,5-8,17H2,1-4H3
InChIKeyBKGPDWNXDNQKBU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Curcuma longa (ncbitaxon:136217) rhizome (BTO:0001181) MetaboLights (MTBLS2790)
Curcuma aromatica (ncbitaxon:136209) rhizome (BTO:0001181) MetaboLights (MTBLS2790)
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)
1,7-bis(3,5-diethyl-4-hydroxyphenyl)-1,6-heptadiene-3,5-dione (CHEBI:176661) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
1,7-bis(3,5-diethyl-4-hydroxyphenyl)hepta-1,6-diene-3,5-dione