CHEBI:67570 - minabeolide 8

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name minabeolide 8
ChEBI ID CHEBI:67570
Definition A withanolide that is (22R,25S)-22,26-epoxycholest-4-en-26-one substituted by an oxo group at position 3 and an α-acetoxy group at position 11. Isolated from Paraminabea acronocephala, it exhibits anti-inflammatory activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C29H42O5
Net Charge 0
Average Mass 470.64080
Monoisotopic Mass 470.30322
InChI InChI=1S/C29H42O5/c1-16-6-11-24(34-27(16)32)17(2)22-9-10-23-21-8-7-19-14-20(31)12-13-28(19,4)26(21)25(33-18(3)30)15-29(22,23)5/h14,16-17,21-26H,6-13,15H2,1-5H3/t16-,17-,21-,22+,23-,24+,25+,26+,28-,29+/m0/s1
InChIKey INZKQBNBXNYQRQ-MOFMAXGTSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4=CC(=O)CC[C@]4(C)[C@@]3([H])[C@@H](C[C@]12C)OC(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 8 (CHEBI:67570) has role anti-inflammatory agent (CHEBI:67079)
minabeolide 8 (CHEBI:67570) has role coral metabolite (CHEBI:76498)
minabeolide 8 (CHEBI:67570) is a δ-lactone (CHEBI:18946)
minabeolide 8 (CHEBI:67570) is a acetate ester (CHEBI:47622)
minabeolide 8 (CHEBI:67570) is a cholestanoid (CHEBI:50401)
minabeolide 8 (CHEBI:67570) is a enone (CHEBI:51689)
minabeolide 8 (CHEBI:67570) is a organic heterotetracyclic compound (CHEBI:38163)
minabeolide 8 (CHEBI:67570) is a withanolide (CHEBI:74716)
IUPAC Name
(11α,22R,25S)-3,26-dioxo-22,26-epoxycholest-4-en-11-yl acetate
Synonyms Sources
28-nor-3-oxo-11α-acetoxy-with-4-enolide ChEBI
minabeolide-8 ChEBI
Registry Number Type Source
21534308 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21425785 PubMed citation Europe PMC
Last Modified
28 November 2013