CHEBI:69070 - daibulactone A, (rel)-

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ChEBI Name daibulactone A, (rel)-
ChEBI ID CHEBI:69070
Definition A natural product found in Neolitsea daibuensis.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H18O5
Net Charge 0
Average Mass 302.32180
Monoisotopic Mass 302.11542
InChI InChI=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
InChIKey IAFGRUKVDHTZPP-MXXQPQJVSA-N
SMILES [H][C@]12OC(=O)C(C[C@@H](OC(C)=O)\C=C(C)\Cc3occ(C)c13)=C2
Metabolite of Species Details
Neolitsea daibuensis (IPNI:466954-1) Found in root (BTO:0001188). Cold MeOH extract of dried roots 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 daibulactone A, (rel)- (CHEBI:69070) has role metabolite (CHEBI:25212)
daibulactone A, (rel)- (CHEBI:69070) is a butenolide (CHEBI:50523)
Synonym Source
3-acetoxylinderalactone ChEBI
Citation Waiting for Citations Type Source
22148193 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enoate ester(CHEBI:51702); ISA:furans(CHEBI:24129); ISA:lactone(CHEBI:25000); ISA:monocarboxylic acid(CHEBI:25384); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);