EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:70285 - Epoxypholamin E, (rel)-

ChEBI IDCHEBI:70285
ChEBI NameEpoxypholamin E, (rel)-
Stars
DefinitionA natural product found in Paraconiothyrium species.
Last Modified22 September 2014
DownloadsMolfile
FormulaC22H32O5
Net Charge0
Average Mass376.493
Monoisotopic Mass376.22497
SMILES[H][C@@]12CC=C(C)[C@H](C[C@@]34O[C@]3([H])C(O)C(C)=CC4O)[C@@]1(C)CCC[C@@]2(C)C(=O)O
InChIInChI=1S/C22H32O5/c1-12-6-7-15-20(3,8-5-9-21(15,4)19(25)26)14(12)11-22-16(23)10-13(2)17(24)18(22)27-22/h6,10,14-18,23-24H,5,7-9,11H2,1-4H3,(H,25,26)/t14-,15+,16?,17?,18+,20+,21+,22-/m0/s1
InChIKeyOQFXTROEGKHUNA-FUOIZCMPSA-N
Species of MetaboliteComponentSourceComments
Paraconiothyrium (ncbitaxon:300251) mycelium (BTO:0001436) PubMed (21114274) Ethyl acetate extract of culture medium and mycelium
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)
Epoxypholamin E, (rel)- (CHEBI:70285) has role metabolite (CHEBI:25212)
Epoxypholamin E, (rel)- (CHEBI:70285) is a polyol (CHEBI:26191)
Manual XrefsDatabases
27022536ChemSpider
Citations