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

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ChEBI Name (-)-3-O-palmitoylloliolide
ChEBI ID CHEBI:70604
Definition A natural product found in Parasenecio deltophyllus.
Stars This entity has been manually annotated by a third party.
Supplier Information ZINC000096086441
Download Molfile XML SDF
Formula C27H46O4
Net Charge 0
Average Mass 434.65170
Monoisotopic Mass 434.33961
InChI InChI=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
InChIKey TUSWWSUBXAJODB-WXVAWEFUSA-N
SMILES CCCCCCCCCCCCCCCC(=O)O[C@H]1CC(C)(C)C2=CC(=O)O[C@]2(C)C1
Metabolite of Species Details
Parasenecio deltophyllus (NCBI:txid186962) Found in aerial part (BTO:0001658). The air-dried aerial parts were powdered and extracted with petroleum ether-Et2O-MeOH See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (-)-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]hexadecanoate ChEBI
Citation Waiting for Citations
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:fatty acid ester(CHEBI:35748); ISA:dicarboxylic acid(CHEBI:35692); ISA:butenolide(CHEBI:50523); ISA:enoate ester(CHEBI:51702); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:lactone(CHEBI:25000); ISA:organonitrogen compound(CHEBI:35352); ISA:ether(CHEBI:25698); ISA:carbonyl compound(CHEBI:36586);