CHEBI:67569 - minabeolide 5

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ChEBI Name minabeolide 5
ChEBI ID CHEBI:67569
Definition A withanolide that is (22R,25S)-22,26-epoxycholesta-1,4-dien-26-one substituted by an oxo group at position 3 and an acetoxy group at position 18. Isolated from Paraminabea acronocephala, it exhibits anti-inflammatory activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C29H40O5
Net Charge 0
Average Mass 468.62490
Monoisotopic Mass 468.28757
InChI InChI=1S/C29H40O5/c1-17-5-10-26(34-27(17)32)18(2)23-8-9-25-22-7-6-20-15-21(31)11-13-28(20,4)24(22)12-14-29(23,25)16-33-19(3)30/h11,13,15,17-18,22-26H,5-10,12,14,16H2,1-4H3/t17-,18-,22+,23+,24-,25-,26+,28-,29-/m0/s1
InChIKey KMDRJFYWGCLAGL-NXAGNEQWSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4=CC(=O)C=C[C@]4(C)[C@@]3([H])CC[C@]12COC(C)=O)[C@H](C)[C@H]1CC[C@H](C)C(=O)O1
Metabolite of Species Details
Paraminabea acronocephala (WORMS:290662) Ethanolic extract of minced frozen bodies See: PubMed
Roles Classification
Biological Role(s): coral metabolite
Any animal metabolite produced during a metabolic reaction in corals (marine invertebrates).
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via withanolide )
Application(s): anti-inflammatory agent
Any compound that has anti-inflammatory effects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing minabeolide 5 (CHEBI:67569) has role anti-inflammatory agent (CHEBI:67079)
minabeolide 5 (CHEBI:67569) has role coral metabolite (CHEBI:76498)
minabeolide 5 (CHEBI:67569) is a δ-lactone (CHEBI:18946)
minabeolide 5 (CHEBI:67569) is a acetate ester (CHEBI:47622)
minabeolide 5 (CHEBI:67569) is a cholestanoid (CHEBI:50401)
minabeolide 5 (CHEBI:67569) is a enone (CHEBI:51689)
minabeolide 5 (CHEBI:67569) is a organic heterotetracyclic compound (CHEBI:38163)
minabeolide 5 (CHEBI:67569) is a withanolide (CHEBI:74716)
IUPAC Name
(22R,25S)-3,26-dioxo-22,26-epoxycholesta-1,4-dien-18-yl acetate
Synonyms Sources
28-nor-3-oxo-18-acetoxy-witha-1,4-dienolide ChEBI
minabeolide-5 ChEBI
Registry Number Type Source
21534306 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21425785 PubMed citation Europe PMC
Last Modified
28 November 2013