CHEBI:70336 - (22E,24R)-3β,5α-dihydroxyergosta-7,22-dien-6-one

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ChEBI Name (22E,24R)-3β,5α-dihydroxyergosta-7,22-dien-6-one ChEBI ID CHEBI:70336 ChEBI ASCII Name (22E,24R)-3beta,5alpha-dihydroxyergosta-7,22-dien-6-one Definition An ergostanoid that is (22E)-ergosta-7,22-diene substituted by hydroxy groups at position 3 and 5 and an oxo group at position 6 (the 3β,5α stereoisomer). It has been isolated from Aspergillus ochraceus. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C28H44O3 Net Charge 0 Average Mass 428.64720 Monoisotopic Mass 428.32905 InChI InChI=1S/C28H44O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-24,29,31H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,22+,23-,24-,26+,27+,28-/m0/s1 InChIKey KAIVGEVOBNIWLR-QIBDZGQISA-N SMILES CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC(=O)[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C Metabolite of Species Details Aspergillus ochraceus (NCBI:txid40380) Found in mycelium (BTO:0001436). MeOH(mycelia) & EtOAc(broth) extract of an endophytic fungus isolated from Sargassum kjellmanianum of strain EN 31 See: PubMed Roles Classification Biological Role(s): Aspergillus metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus . View more via ChEBI Ontology ChEBI Ontology Outgoing (22E,24R)-3β,5α-dihydroxyergosta-7,22-dien-6-one (CHEBI:70336) has role Aspergillus metabolite (CHEBI:76956) (22E,24R)-3β,5α-dihydroxyergosta-7,22-dien-6-one (CHEBI:70336) is a 3β-hydroxy steroid (CHEBI:36836) (22E,24R)-3β,5α-dihydroxyergosta-7,22-dien-6-one (CHEBI:70336) is a 5α-hydroxy steroid (CHEBI:38194) (22E,24R)-3β,5α-dihydroxyergosta-7,22-dien-6-one (CHEBI:70336) is a 6-oxo steroid (CHEBI:36883) (22E,24R)-3β,5α-dihydroxyergosta-7,22-dien-6-one (CHEBI:70336) is a ergostanoid (CHEBI:50403) (22E,24R)-3β,5α-dihydroxyergosta-7,22-dien-6-one (CHEBI:70336) is a tertiary α-hydroxy ketone (CHEBI:139592) IUPAC Name (3β,5α,22E)-3,5-dihydroxyergosta-7,22-dien-6-one Registry Number Type Source 3174364 Reaxys Registry Number Reaxys Citation Type Source 21043476 PubMed citation Europe PMC Last Modified 06 February 2018