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CHEBI:132822 - salicifoliol

ChEBI IDCHEBI:132822
ChEBI Namesalicifoliol
Stars
DefinitionA lignan that is tetrahydro-1H,3H-furo[3,4-c]furan-1-one carrying a 4-hydroxy-3-methoxyphenyl substituent at position 4.
Last Modified12 April 2017
Submitterliuqingping
DownloadsMolfile
FormulaC13H14O5
Net Charge0
Average Mass250.250
Monoisotopic Mass250.08412
SMILES[H][C@]12CO[C@H](c3ccc(O)c(OC)c3)[C@@]1([H])COC2=O
InChIInChI=1S/C13H14O5/c1-16-11-4-7(2-3-10(11)14)12-8-5-18-13(15)9(8)6-17-12/h2-4,8-9,12,14H,5-6H2,1H3/t8-,9-,12+/m0/s1
InChIKeyHYZRWYQBGNTGTK-HOTUBEGUSA-N
Species of MetaboliteComponentSourceComments
Sesamum indicum (ncbitaxon:4182) seed (BTO:0001226) PubMed (11540412)
Wikstroemia indica (ncbitaxon:714517) root (BTO:0001188) PubMed (24660446) Obtained from the powdered roots
Eucommia ulmoides (ncbitaxon:4392) - PubMed (26767291)
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)
salicifoliol (CHEBI:132822) has role plant metabolite (CHEBI:76924)
salicifoliol (CHEBI:132822) is a furofuran (CHEBI:47790)
salicifoliol (CHEBI:132822) is a guaiacols (CHEBI:134251)
salicifoliol (CHEBI:132822) is a lignan (CHEBI:25036)
salicifoliol (CHEBI:132822) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(3aR,4S,6aR)-4-(4-hydroxy-3-methoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan-1-one
Registry NumbersSources
Reaxys:21633389Reaxys
Citations