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CHEBI:69101 - Sphaeropsidin B

ChEBI IDCHEBI:69101
ChEBI NameSphaeropsidin B
Stars
DefinitionA natural product found in Diplodia cupressi.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H28O5
Net Charge0
Average Mass348.439
Monoisotopic Mass348.19367
SMILES[H][C@]12C(C)(C)CCC[C@@]13C(=O)O[C@]2(O)[C@H](O)C1=C[C@@](C)(C=C)CC[C@@]13O
InChIInChI=1S/C20H28O5/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/h5,11,13-14,21,23-24H,1,6-10H2,2-4H3/t13-,14+,17+,18+,19-,20-/m1/s1
InChIKeyXJXDJAQAAAVDCT-RHOFUAETSA-N
Species of MetaboliteComponentSourceComments
Diplodia cupressi (ncbitaxon:400389) - PubMed (22124378) Strain: 261.85CBS
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 B (CHEBI:69101) has role metabolite (CHEBI:25212)
Sphaeropsidin B (CHEBI:69101) is a γ-lactone (CHEBI:37581)
Citations