CHEBI:67822 - gustastatin

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ChEBI Name gustastatin
ChEBI ID CHEBI:67822
Definition A natural product found in Cupania cinerea.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C31H40O9
Net Charge 0
Average Mass 556.64390
Monoisotopic Mass 556.26723
InChI InChI=1S/C31H40O9/c1-6-8-10-12-22(32)14-20-16-24(37-3)18-26(34)28(20)31(36)40-25-17-21(15-23(33)13-11-9-7-2)29(30(35)39-5)27(19-25)38-4/h16-19,34H,6-15H2,1-5H3
InChIKey FHOVJOXBAHBKGJ-UHFFFAOYSA-N
SMILES CCCCCC(=O)Cc1cc(OC)cc(O)c1C(=O)Oc1cc(CC(=O)CCCCC)c(C(=O)OC)c(OC)c1
Metabolite of Species Details
Cupania cinerea (NCBI:txid298314) Found in bark (BTO:0001301). Crude n-hexane extract of dried and powdered bark 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 gustastatin (CHEBI:67822) has role metabolite (CHEBI:25212)
gustastatin (CHEBI:67822) is a carbonyl compound (CHEBI:36586)
Synonym Source
[3-methoxy-4-methoxycarbonyl-5-(2-oxoheptyl)phenyl]2-hydroxy-4-methoxy-6-(2-oxoheptyl)benzoate ChEBI
Citation Waiting for Citations Type Source
21438586 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:methoxybenzoic acid(CHEBI:25238); ISA:benzenes(CHEBI:22712); ISA:carbonyl compound(CHEBI:36586); ISA:phenols(CHEBI:33853); ISA:benzoate ester(CHEBI:36054); ISA:methoxybenzene(CHEBI:51683); ISA:benzyl ether(CHEBI:59859); ISA:aromatic ether(CHEBI:35618); ISA:dicarboxylic acid(CHEBI:35692); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:carboxylic ester(CHEBI:33308); ISA:enol(CHEBI:33823); ISA:ketone(CHEBI:17087); ISA:organic heterocyclic compound(CHEBI:24532); ISA:organonitrogen compound(CHEBI:35352); ISA:aromatic alcohol(CHEBI:33854);