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CHEBI:70604 - (-)-3-O-palmitoylloliolide

ChEBI IDCHEBI:70604
ChEBI Name(-)-3-O-palmitoylloliolide
Stars
DefinitionA natural product found in Parasenecio deltophyllus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC27H46O4
Net Charge0
Average Mass434.661
Monoisotopic Mass434.33961
SMILESCCCCCCCCCCCCCCCC(=O)O[C@H]1CC(C)(C)C2=CC(=O)O[C@]2(C)C1
InChIInChI=1S/C27H46O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(28)30-22-20-26(2,3)23-19-25(29)31-27(23,4)21-22/h19,22H,5-18,20-21H2,1-4H3/t22-,27+/m0/s1
InChIKeyTUSWWSUBXAJODB-WXVAWEFUSA-N
Species of MetaboliteComponentSourceComments
Parasenecio deltophyllus (ncbitaxon:186962) aerial part (BTO:0001658) PubMed (20968296) The air-dried aerial parts were powdered and extracted with petroleum ether-Et2O-MeOH
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
(-)-3-O-palmitoylloliolide (CHEBI:70604) has role metabolite (CHEBI:25212)
(-)-3-O-palmitoylloliolide (CHEBI:70604) is a benzofurans (CHEBI:35259)
Synonym  Source
[(6S,7aR)-4,4,7a-trimethyl-2-oxo-6,7-dihydro-5H-1-benzofuran-6-yl]hexadecanoateChEBI
Citations