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CHEBI:69494 - Sphaeropsidin A

ChEBI IDCHEBI:69494
ChEBI NameSphaeropsidin A
Stars
DefinitionA natural product found in Smardaea species and Diplodia cupressi.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H26O5
Net Charge0
Average Mass346.423
Monoisotopic Mass346.17802
SMILES[H][C@]12C(C)(C)CCC[C@@]13C(=O)O[C@]2(O)C(=O)C1=C[C@@](C)(C=C)CC[C@@]13O
InChIInChI=1S/C20H26O5/c1-5-17(4)9-10-19(23)12(11-17)13(21)20(24)14-16(2,3)7-6-8-18(14,19)15(22)25-20/h5,11,14,23-24H,1,6-10H2,2-4H3/t14-,17-,18-,19+,20+/m0/s1
InChIKeyFEKFUWWVNCCROX-SQWSIXGCSA-N
Species of MetaboliteComponentSourceComments
Diplodia cupressi (ncbitaxon:400389) - PubMed (22124378) Strain: 261.85CBS
Smardaea (ncbitaxon:173111) - PubMed (21999655) Ethyl acetate extract,Endophytic fungus in the living photosynthetic tissue of Ceratodon purpureus. Strain: AZ0432
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Sphaeropsidin A (CHEBI:69494) has role metabolite (CHEBI:25212)
Sphaeropsidin A (CHEBI:69494) is a γ-lactone (CHEBI:37581)
Synonym  Source
(6beta,13alpha)-6,9-Dihydroxy-6,20-epoxypimara-8(14),15-diene-7,20-dioneChEBI
Citations