CHEBI:69213 - methyl tumonoate A

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ChEBI Name methyl tumonoate A
ChEBI ID CHEBI:69213
Definition A natural product found particularly in Oscillatoria margaritifera and Oscillatoria margaritifera.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H35NO4
Net Charge 0
Average Mass 353.49620
Monoisotopic Mass 353.25661
InChI InChI=1S/C20H35NO4/c1-5-6-7-8-9-10-12-15(2)18(22)16(3)19(23)21-14-11-13-17(21)20(24)25-4/h12,16-18,22H,5-11,13-14H2,1-4H3/b15-12+/t16-,17+,18-/m1/s1
InChIKey SZDORSKCYIOHRW-HOOHWIHRSA-N
SMILES CCCCCCC\C=C(/C)[C@@H](O)[C@@H](C)C(=O)N1CCC[C@H]1C(=O)OC
Metabolite of Species Details
Oscillatoria margaritifera (NCBI:txid748017) Extracted with CHCl2/MeOH (2:1) of strain NAC8 45 See: PubMed
Oscillatoria margaritifera (NCBI:txid748017) Extracted with CHCl2/MeOH (2:1) of strain NAC8 46 See: PubMed
Oscillatoria margaritifera NAC8-54 (NCBI:txid748039) Extracted with CHCl2/MeOH (2:1) See: PubMed
Oscillatoria margaritifera NAC8-55 (NCBI:txid748040) Extracted with CHCl2/MeOH (2:1) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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 methyl tumonoate A (CHEBI:69213) has role metabolite (CHEBI:25212)
methyl tumonoate A (CHEBI:69213) is a N-acyl-amino acid (CHEBI:51569)
Synonym Source
Methyl 1-[(2R,3S,4E)-3-hydroxy-2,4-dimethyl-4-dodecenoyl]-L-prolinate ChEBI
Citation Waiting for Citations Type Source
21751786 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:alpha-amino acid ester(CHEBI:46874); ISA:N-acylpyrrolidine(CHEBI:46766); ISA:pyrrolidinecarboxylic acid(CHEBI:46767); ISA:carboxylic acid(CHEBI:33575); ISA:fatty amide(CHEBI:29348); ISA:carboxylic ester(CHEBI:33308); ISA:amino alcohol(CHEBI:22478); ISA:carboxamide(CHEBI:37622); ISA:tertiary amine(CHEBI:32876); ISA:secondary alcohol(CHEBI:35681); ISA:organonitrogen compound(CHEBI:35352); ISA:ether(CHEBI:25698); ISA:monocarboxylic acid(CHEBI:25384); ISA:carbonyl compound(CHEBI:36586);