CHEBI:70334 - 3β-hydroxyergosta-8,24(28)-dien-7-one

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ChEBI Name 3β-hydroxyergosta-8,24(28)-dien-7-one ChEBI ID CHEBI:70334 ChEBI ASCII Name 3beta-hydroxyergosta-8,24(28)-dien-7-one Definition An ergostanoid that is (5α)-ergosta-8,24(28)-diene substituted by a β-hydroxy group at position 3 and an oxo group at position 7. 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 C28H44O2 Net Charge 0 Average Mass 412.64780 Monoisotopic Mass 412.33413 InChI InChI=1S/C28H44O2/c1-17(2)18(3)7-8-19(4)22-9-10-23-26-24(12-14-28(22,23)6)27(5)13-11-21(29)15-20(27)16-25(26)30/h17,19-23,29H,3,7-16H2,1-2,4-6H3/t19-,20-,21+,22-,23+,27+,28-/m1/s1 InChIKey XNNFSCUGVQFHNA-KLARHEOWSA-N SMILES CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C[C@@H]1CC3=O 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 3β-hydroxyergosta-8,24(28)-dien-7-one (CHEBI:70334) has parent hydride 5α-ergostane (CHEBI:20652) 3β-hydroxyergosta-8,24(28)-dien-7-one (CHEBI:70334) has role Aspergillus metabolite (CHEBI:76956) 3β-hydroxyergosta-8,24(28)-dien-7-one (CHEBI:70334) is a 3β-hydroxy steroid (CHEBI:36836) 3β-hydroxyergosta-8,24(28)-dien-7-one (CHEBI:70334) is a 7-oxo steroid (CHEBI:47789) 3β-hydroxyergosta-8,24(28)-dien-7-one (CHEBI:70334) is a ergostanoid (CHEBI:50403) IUPAC Name (3β,5α)-3-hydroxyergosta-8,24(28)-dien-7-one Registry Number Type Source 21092008 Reaxys Registry Number Reaxys Citation Type Source 21043476 PubMed citation Europe PMC Last Modified 13 January 2014