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CHEBI:69070 - daibulactone A, (rel)-

ChEBI IDCHEBI:69070
ChEBI Namedaibulactone A, (rel)-
Stars
DefinitionA natural product found in Neolitsea daibuensis.
Last Modified22 September 2014
DownloadsMolfile
FormulaC17H18O5
Net Charge0
Average Mass302.326
Monoisotopic Mass302.11542
SMILES[H][C@@]12C=C(C[C@@H](OC(C)=O)/C=C(\C)Cc3occ(C)c31)C(=O)O2
InChIInChI=1S/C17H18O5/c1-9-4-13(21-11(3)18)6-12-7-15(22-17(12)19)16-10(2)8-20-14(16)5-9/h4,7-8,13,15H,5-6H2,1-3H3/b9-4+/t13-,15+/m0/s1
InChIKeyIAFGRUKVDHTZPP-MXXQPQJVSA-N
Species of MetaboliteComponentSourceComments
Neolitsea daibuensis (IPNI:466954-1) root (BTO:0001188) PubMed (22148193) Cold MeOH extract of dried roots
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)
daibulactone A, (rel)- (CHEBI:69070) has role metabolite (CHEBI:25212)
daibulactone A, (rel)- (CHEBI:69070) is a butenolide (CHEBI:50523)
Synonym  Source
3-acetoxylinderalactoneChEBI
Citations