CHEBI:70522 - Meliasenin N

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ChEBI Name Meliasenin N
ChEBI ID CHEBI:70522
Definition A natural product found in Melia toosendan.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C30H44O5
Net Charge 0
Average Mass 484.66740
Monoisotopic Mass 484.31887
InChI InChI=1S/C30H44O5/c1-17(2)21(35-33)10-8-18-25-22(34-26(18)32)16-30(7)20-9-11-23-27(3,4)24(31)13-14-28(23,5)19(20)12-15-29(25,30)6/h9,18-19,21-23,25,33H,1,8,10-16H2,2-7H3/t18-,19+,21+,22+,23+,25-,28-,29+,30-/m1/s1
InChIKey HASDXLPYERWHOW-WOALYQRUSA-N
SMILES [H][C@]12C[C@]3(C)C4=CC[C@@]5([H])C(C)(C)C(=O)CC[C@]5(C)[C@@]4([H])CC[C@@]3(C)[C@]1([H])[C@@]([H])(CC[C@H](OO)C(C)=C)C(=O)O2
Metabolite of Species Details
Melia toosendan (NCBI:txid71608) Found in fruit (BTO:0000486). 95% ethanolic extract of dried fruits 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 Meliasenin N (CHEBI:70522) has role metabolite (CHEBI:25212)
Meliasenin N (CHEBI:70522) is a triterpenoid (CHEBI:36615)
Synonym Source
(24S)-hydroperoxyeupha-7,25-dien-3-oxo-16beta,21beta-olide ChEBI
Citation Waiting for Citations Type Source
20961091 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:steroid lactone(CHEBI:26766); ISA:3-oxo Delta(7)-steroid(CHEBI:71598); ISA:3-oxo steroid(CHEBI:47788); ISA:steroid(CHEBI:35341); ISA:terpene lactone(CHEBI:37668); ISA:cyclohexanones(CHEBI:23482); ISA:gamma-lactone(CHEBI:37581); ISA:oxolanes(CHEBI:26912); ISA:carboxylic ester(CHEBI:33308); ISA:peroxol(CHEBI:35924); ISA:ether(CHEBI:25698);