CHEBI:67564 - paraminabeolide E

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ChEBI Name paraminabeolide E
ChEBI ID CHEBI:67564
Definition A withanolide that is the C-25 epimer of paraminabeolide D. It has been isolated from a Formosan soft coral Paraminabea acronocephala.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H40O4
Net Charge 0
Average Mass 440.61480
Monoisotopic Mass 440.29266
InChI InChI=1S/C28H40O4/c1-15-16(2)26(31)32-25(15)24(30)17(3)21-8-9-22-20-7-6-18-14-19(29)10-12-27(18,4)23(20)11-13-28(21,22)5/h10,12,14-17,20-25,30H,6-9,11,13H2,1-5H3/t15-,16-,17-,20-,21+,22-,23-,24-,25+,27-,28+/m0/s1
InChIKey UISXVQNCBCKQHL-RKXKHITBSA-N
SMILES C[C@H]([C@H](O)[C@@H]1OC(=O)[C@@H](C)[C@@H]1C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing paraminabeolide E (CHEBI:67564) has role coral metabolite (CHEBI:76498)
paraminabeolide E (CHEBI:67564) is a γ-lactone (CHEBI:37581)
paraminabeolide E (CHEBI:67564) is a 3-oxo-Δ1,Δ4-steroid (CHEBI:77166)
paraminabeolide E (CHEBI:67564) is a ergostanoid (CHEBI:50403)
paraminabeolide E (CHEBI:67564) is a secondary alcohol (CHEBI:35681)
paraminabeolide E (CHEBI:67564) is a withanolide (CHEBI:74716)
IUPAC Name
(22S,23R,24S,25S)-22-hydroxy-23,26-epoxyergosta-1,4-diene-3,26-dione
Registry Number Type Source
21534302 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21425785 PubMed citation Europe PMC
Last Modified
30 January 2014