CHEBI:70339 - (22E,24R)-ergosta-5α,6α-epoxide-8,22-diene-3β,7α-diol

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ChEBI Name (22E,24R)-ergosta-5α,6α-epoxide-8,22-diene-3β,7α-diol ChEBI ID CHEBI:70339 ChEBI ASCII Name (22E,24R)-ergosta-5alpha,6alpha-epoxide-8,22-diene-3beta,7alpha-diol Definition An ergostanoid that is (22E)-ergosta-7,22-diene substituted by hydroxy groups at positions 3 and 7 and an epoxy group across positions 5 and 6 (the 3β,5α,6α,7α stereoisomer). It has been isolated from Aspergillus ochraceus as well as Penicillium commune. 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/c1-16(2)17(3)7-8-18(4)20-9-10-21-23-22(12-13-26(20,21)5)27(6)14-11-19(29)15-28(27)25(31-28)24(23)30/h7-8,16-21,24-25,29-30H,9-15H2,1-6H3/b8-7+/t17-,18+,19-,20+,21-,24-,25-,26+,27+,28-/m0/s1 InChIKey PCIZFQVDNDHRPP-WOIVZMLFSA-N SMILES CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C[C@@]11O[C@H]1[C@H]3O Metabolite of Species Details Penicillium commune (NCBI:txid36653) Found in mycelium (BTO:0001436). Methanolic extract of mycelia and ethyl acetate extract of culture broth See: PubMed 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 . Penicillium metabolite Any fungal metabolite produced during a metabolic reaction in Penicillium. View more via ChEBI Ontology ChEBI Ontology Outgoing (22E,24R)-ergosta-5α,6α-epoxide-8,22-diene-3β,7α-diol (CHEBI:70339) has role Aspergillus metabolite (CHEBI:76956) (22E,24R)-ergosta-5α,6α-epoxide-8,22-diene-3β,7α-diol (CHEBI:70339) has role Penicillium metabolite (CHEBI:76964) (22E,24R)-ergosta-5α,6α-epoxide-8,22-diene-3β,7α-diol (CHEBI:70339) is a 3β-hydroxy steroid (CHEBI:36836) (22E,24R)-ergosta-5α,6α-epoxide-8,22-diene-3β,7α-diol (CHEBI:70339) is a 7α-hydroxy steroid (CHEBI:36843) (22E,24R)-ergosta-5α,6α-epoxide-8,22-diene-3β,7α-diol (CHEBI:70339) is a epoxy steroid (CHEBI:145217) (22E,24R)-ergosta-5α,6α-epoxide-8,22-diene-3β,7α-diol (CHEBI:70339) is a ergostanoid (CHEBI:50403) IUPAC Name (3β,5α,6α,7α,22E)-5,6-epoxyergosta-8,22-diene-3,7-diol Registry Number Type Source 54087 Reaxys Registry Number Reaxys Citations Types Sources 21043476 PubMed citation Europe PMC 21226488 PubMed citation Europe PMC Last Modified 28 October 2019