CHEBI:67565 - paraminabeolide F

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ChEBI Name paraminabeolide F
ChEBI ID CHEBI:67565
Definition A withanolide that is 18,22:23,26-diepoxyergosta-1,4-diene substituted by oxo groups at positions 3, 18 and 26. It has been isolated from a Formosan soft coral Paraminabea acronocephala.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C28H36O5
Net Charge 0
Average Mass 452.58240
Monoisotopic Mass 452.25627
InChI InChI=1S/C28H36O5/c1-14-15(2)25(30)32-23(14)24-16(3)20-7-8-22-19-6-5-17-13-18(29)9-11-27(17,4)21(19)10-12-28(20,22)26(31)33-24/h9,11,13-16,19-24H,5-8,10,12H2,1-4H3/t14-,15-,16+,19-,20-,21+,22+,23-,24+,27+,28+/m1/s1
InChIKey CSYZCEMSEOUURJ-NQRURKCISA-N
SMILES C[C@@H]1[C@@H](C)C(=O)OC1[C@H]1OC(=O)[C@]23CC[C@H]4[C@@H](CCC5=CC(=O)C=C[C@]45C)[C@@H]2CC[C@@H]3[C@@H]1C
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 F (CHEBI:67565) has role coral metabolite (CHEBI:76498)
paraminabeolide F (CHEBI:67565) is a γ-lactone (CHEBI:37581)
paraminabeolide F (CHEBI:67565) is a enone (CHEBI:51689)
paraminabeolide F (CHEBI:67565) is a ergostanoid (CHEBI:50403)
paraminabeolide F (CHEBI:67565) is a withanolide (CHEBI:74716)
IUPAC Name
(22S,23R,25R)-18,22:23,26-diepoxyergosta-1,4-diene-3,18,26-trione
Registry Number Type Source
21534304 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21425785 PubMed citation Europe PMC
Last Modified
28 November 2013