CHEBI:68225 - (7R,8R)-α-diversonolic ester

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ChEBI Name (7R,8R)-α-diversonolic ester ChEBI ID CHEBI:68225 ChEBI ASCII Name (7R,8R)-alpha-diversonolic ester Definition A member of the class of xanthones that is methyl 2,3,4,9-tetrahydro-1H-xanthene-1-carboxylate substituted by hydroxy groups at positions 1, 2 and 8, a methyl group at position 6 and an oxo group at position 9 (the 1R,2R stereoisomer). It has been isolated from the sea fan derived fungus Aspergillus sydowii. 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 C16H16O7 Net Charge 0 Average Mass 320.29400 Monoisotopic Mass 320.08960 InChI InChI=1S/C16H16O7/c1-7-5-8(17)12-10(6-7)23-9-3-4-11(18)16(21,15(20)22-2)13(9)14(12)19/h5-6,11,17-18,21H,3-4H2,1-2H3/t11-,16+/m1/s1 InChIKey YZMBEUQMDLBCDY-BZNIZROVSA-N SMILES COC(=O)[C@]1(O)[C@H](O)CCc2oc3cc(C)cc(O)c3c(=O)c12 Metabolite of Species Details Aspergillus sydowii (NCBI:txid75750) Ethyl acetate extract of culture broth, fungus isolated from a sea fan, Annella sp. of strain PSU F154 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 (7R,8R)-α-diversonolic ester (CHEBI:68225) has role Aspergillus metabolite (CHEBI:76956) (7R,8R)-α-diversonolic ester (CHEBI:68225) is a methyl ester (CHEBI:25248) (7R,8R)-α-diversonolic ester (CHEBI:68225) is a phenols (CHEBI:33853) (7R,8R)-α-diversonolic ester (CHEBI:68225) is a secondary alcohol (CHEBI:35681) (7R,8R)-α-diversonolic ester (CHEBI:68225) is a tertiary alcohol (CHEBI:26878) (7R,8R)-α-diversonolic ester (CHEBI:68225) is a xanthones (CHEBI:51149) IUPAC Name methyl (1R,2R)-1,2,8-trihydroxy-6-methyl-9-oxo-2,3,4,9-tetrahydro-1H-xanthene-1-carboxylate Registry Number Type Source 18855374 Reaxys Registry Number Reaxys Citation Type Source 21718031 PubMed citation Europe PMC Last Modified 03 March 2015