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CHEBI:94625 - 2-[2-[[2-[[2-[2-(2-hydroxyethoxy)ethoxymethoxy]-3-[[2-[2-(2-hydroxyethoxy)ethoxymethoxy]-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenoxy]methoxy]ethoxy]ethanol

ChEBI IDCHEBI:94625
ChEBI Name2-[2-[[2-[[2-[2-(2-hydroxyethoxy)ethoxymethoxy]-3-[[2-[2-(2-hydroxyethoxy)ethoxymethoxy]-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenoxy]methoxy]ethoxy]ethanol
Stars
Last Modified3 March 2016
DownloadsMolfile
FormulaC59H96O12
Net Charge0
Average Mass997.405
Monoisotopic Mass996.69018
SMILESCC(C)(C)CC(C)(C)c1ccc(OCOCCOCCO)c(Cc2cc(C(C)(C)CC(C)(C)C)cc(Cc3cc(C(C)(C)CC(C)(C)C)ccc3OCOCCOCCO)c2OCOCCOCCO)c1
InChIInChI=1S/C59H96O12/c1-54(2,3)38-57(10,11)48-16-18-51(69-41-66-29-26-63-23-20-60)44(34-48)32-46-36-50(59(14,15)40-56(7,8)9)37-47(53(46)71-43-68-31-28-65-25-22-62)33-45-35-49(58(12,13)39-55(4,5)6)17-19-52(45)70-42-67-30-27-64-24-21-61/h16-19,34-37,60-62H,20-33,38-43H2,1-15H3
InChIKeyZLWMZCWKIALKPX-UHFFFAOYSA-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)
2-[2-[[2-[[2-[2-(2-hydroxyethoxy)ethoxymethoxy]-3-[[2-[2-(2-hydroxyethoxy)ethoxymethoxy]-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenoxy]methoxy]ethoxy]ethanol (CHEBI:94625) is a diarylheptanoid (CHEBI:78802)
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