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CHEBI:70288 - Torrubiellone C

ChEBI IDCHEBI:70288
ChEBI NameTorrubiellone C
Stars
DefinitionA natural product found in Torrubiella species.
Last Modified22 September 2014
DownloadsMolfile
FormulaC22H23NO5
Net Charge0
Average Mass381.428
Monoisotopic Mass381.15762
SMILESCCC(/C=C/C=C/C=C/C(=O)c1c(O)c(-c2ccc(O)cc2)cnc1=O)CO
InChIInChI=1S/C22H23NO5/c1-2-15(14-24)7-5-3-4-6-8-19(26)20-21(27)18(13-23-22(20)28)16-9-11-17(25)12-10-16/h3-13,15,24-25H,2,14H2,1H3,(H2,23,27,28)/b4-3+,7-5+,8-6+
InChIKeyBKSPTJGGAGGDSV-OKWWDJPNSA-N
Species of MetaboliteComponentSourceComments
Torrubiella (ncbitaxon:153665) - PubMed (21090800) Ethyl acetate extract of culture broth, Torrubiella sp.isolated from a spider(araneae) Strain: BCC 2165
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)
Torrubiellone C (CHEBI:70288) has role metabolite (CHEBI:25212)
Torrubiellone C (CHEBI:70288) is a phenylpyridine (CHEBI:38193)
Synonym  Source
4-hydroxy-3-[(2E,4E,6E)-8-(hydroxymethyl)deca-2,4,6-trienoyl]-5-(4-hydroxyphenyl)-1H-pyridin-2-oneChEBI
Citations