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CHEBI:70599 - 14-angeloyloxydeltonorcacalol

ChEBI IDCHEBI:70599
ChEBI Name14-angeloyloxydeltonorcacalol
Stars
DefinitionA natural product found in Parasenecio deltophyllus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H24O5
Net Charge0
Average Mass344.407
Monoisotopic Mass344.16237
SMILESC/C=C(/C)C(=O)OCc1c(C(C)=O)c(O)c(OC)c2c1[C@@H](C)CC=C2
InChIInChI=1S/C20H24O5/c1-6-11(2)20(23)25-10-15-16-12(3)8-7-9-14(16)19(24-5)18(22)17(15)13(4)21/h6-7,9,12,22H,8,10H2,1-5H3/b11-6-/t12-/m0/s1
InChIKeyQCIYZQPUFWEBMV-DSDFTUOUSA-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)
14-angeloyloxydeltonorcacalol (CHEBI:70599) has role metabolite (CHEBI:25212)
14-angeloyloxydeltonorcacalol (CHEBI:70599) is a naphthols (CHEBI:25392)
Synonym  Source
[(8S)-2-acetyl-3-hydroxy-4-methoxy-8-methyl-7,8-dihydronaphthalen-1-yl]methyl (Z)-2-methylbut-2-enoateChEBI
Citations