CHEBI:66358 - Vilmorrianone

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ChEBI Name Vilmorrianone
ChEBI ID CHEBI:66358
Definition A natural product found in Aconitum vilmorinianum and Delphinium denudatum.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H27NO5
Net Charge 0
Average Mass 397.46420
Monoisotopic Mass 397.18892
InChI InChI=1S/C23H27NO5/c1-10-6-22-14-5-13(10)16(26)15(22)19-23(14)8-12(29-11(2)25)7-21(3,9-24(19)4)18(23)17(27)20(22)28/h12-15,18-19H,1,5-9H2,2-4H3/t12-,13-,14+,15+,18+,19+,21-,22+,23+/m0/s1
InChIKey MCKIOPXSFPCTTR-NGELOBKFSA-N
SMILES [H][C@]12C[C@]3([H])[C@@]4(CC1=C)C(=O)C(=O)[C@]1([H])[C@@]5(C)C[C@@H](C[C@@]31[C@]([H])(N(C)C5)[C@@]4([H])C2=O)OC(C)=O
Metabolite of Species Details
Delphinium denudatum (IPNI:710557-1) Found in root (BTO:0001188). See: PubMed
Aconitum vilmorinianum (NCBI:txid226101) Found in root (BTO:0001188). 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.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Vilmorrianone (CHEBI:66358) has role metabolite (CHEBI:25212)
Vilmorrianone (CHEBI:66358) is a diterpene alkaloid (CHEBI:23847)
Citations Waiting for Citations Types Sources
17226159 PubMed citation Europe PMC
9170290 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:quinolone(CHEBI:23765); ISA:cyclohexanones(CHEBI:23482); ISA:piperidines(CHEBI:26151); ISA:carboxylic ester(CHEBI:33308); ISA:tertiary amine(CHEBI:32876); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352);