CHEBI:69752 - mekongensine

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ChEBI Name mekongensine
ChEBI ID CHEBI:69752
Definition A natural product found in Maytenus mekongensis.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C45H51NO20
Net Charge 0
Average Mass 925.88110
Monoisotopic Mass 925.30044
InChI InChI=1S/C45H51NO20/c1-22(47)57-21-44-36(61-25(4)50)32(59-23(2)48)31-34(63-38(53)28-14-11-10-12-15-28)45(44)43(9,56)35(33(60-24(3)49)37(44)62-26(5)51)64-40(55)41(7,65-27(6)52)18-17-30-29(16-13-19-46-30)39(54)58-20-42(31,8)66-45/h10-16,19,31-37,56H,17-18,20-21H2,1-9H3/t31-,32-,33+,34-,35+,36-,37+,41+,42+,43+,44+,45+/m1/s1
InChIKey ZOOHSIOMIRBBDY-DLKMHDBTSA-N
SMILES [H][C@]12OC(=O)[C@](C)(CCc3ncccc3C(=O)OC[C@]3(C)O[C@@]4([C@H](OC(=O)c5ccccc5)[C@@]3([H])[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@]4(COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O)[C@@]2(C)O)OC(C)=O
Metabolite of Species Details
Maytenus mekongensis (NCBI:txid123430) Found in root (BTO:0001188). Methylene dichloride fraction of 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 mekongensine (CHEBI:69752) has role metabolite (CHEBI:25212)
mekongensine (CHEBI:69752) is a terpene lactone (CHEBI:37668)
Synonyms Sources
(1S,3R,15S,18S,19R,20R,21S,22S,23R,24R,25R,26S)-15,19,20,22,23-Pentaacetoxy-21-(acetoxymethyl)-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0[1,21].0[3,24].0[7,12]]hex acosa-7,9,11-trien-25-yl benzoate ChEBI
2,9'-di-O-acetyl-5-O-benzoyl-5-deacetylwilforidine ChEBI
Citation Waiting for Citations Type Source
21634414 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:sesquiterpenoid(CHEBI:26658); ISA:organooxygen compound(CHEBI:36963); HFP:tetracarboxylic acid(CHEBI:35742); ISA:benzoate ester(CHEBI:36054); ISA:pyridines(CHEBI:26421); ISA:aromatic carboxylic acid(CHEBI:33859); ISA:benzyl ether(CHEBI:59859); ISA:carbonyl compound(CHEBI:36586); ISA:oxacycle(CHEBI:38104); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:tertiary alcohol(CHEBI:26878); ISA:oxolanes(CHEBI:26912); ISA:carboxylic ester(CHEBI:33308); ISA:lactone(CHEBI:25000); ISA:organic hydroxy compound(CHEBI:33822); ISA:organonitrogen compound(CHEBI:35352); ISA:ether(CHEBI:25698);