CHEBI:67566 - minabeolide 1

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ChEBI Name minabeolide 1
ChEBI ID CHEBI:67566
Definition A withanolide that is (22R)-22,26-epoxyergosta-1,4,24-triene substituted by oxo groups at positions 3 and 26. Isolated from Paraminabea acronocephala, it exhibits antineoplastic and anti-inflammatory activities.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H38O3
Net Charge 0
Average Mass 422.59950
Monoisotopic Mass 422.28210
InChI InChI=1S/C28H38O3/c1-16-14-25(31-26(30)17(16)2)18(3)22-8-9-23-21-7-6-19-15-20(29)10-12-27(19,4)24(21)11-13-28(22,23)5/h10,12,15,18,21-25H,6-9,11,13-14H2,1-5H3/t18-,21-,22+,23-,24-,25+,27-,28+/m0/s1
InChIKey XNASBJNLSIWJAM-CCSWOSDBSA-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@]12C)[C@H](C)[C@H]1CC(C)=C(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.
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing minabeolide 1 (CHEBI:67566) has role anti-inflammatory agent (CHEBI:67079)
minabeolide 1 (CHEBI:67566) has role antineoplastic agent (CHEBI:35610)
minabeolide 1 (CHEBI:67566) has role coral metabolite (CHEBI:76498)
minabeolide 1 (CHEBI:67566) is a δ-lactone (CHEBI:18946)
minabeolide 1 (CHEBI:67566) is a 3-oxo-Δ1,Δ4-steroid (CHEBI:77166)
minabeolide 1 (CHEBI:67566) is a ergostanoid (CHEBI:50403)
minabeolide 1 (CHEBI:67566) is a organic heterotetracyclic compound (CHEBI:38163)
minabeolide 1 (CHEBI:67566) is a withanolide (CHEBI:74716)
IUPAC Name
(22R)-22,26-epoxyergosta-1,4,24-triene-3,26-dione
Synonyms Sources
3-oxo-witha-1,4,24-trienolide ChEBI
minabeolide-1 ChEBI
Registry Number Type Source
21534300 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21425785 PubMed citation Europe PMC
Last Modified
30 January 2014