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CHEBI:70289 - Torrubiellone D

ChEBI IDCHEBI:70289
ChEBI NameTorrubiellone D
Stars
DefinitionA natural product found in Torrubiella species.
Last Modified22 September 2014
DownloadsMolfile
FormulaC22H25NO5
Net Charge0
Average Mass383.444
Monoisotopic Mass383.17327
SMILESCCC(/C=C/C=C/C=C/C(O)=C1\C(=O)NC(Cc2ccc(O)cc2)C1=O)CO
InChIInChI=1S/C22H25NO5/c1-2-15(14-24)7-5-3-4-6-8-19(26)20-21(27)18(23-22(20)28)13-16-9-11-17(25)12-10-16/h3-12,15,18,24-26H,2,13-14H2,1H3,(H,23,28)/b4-3+,7-5+,8-6+,20-19+
InChIKeyTVSMLVYMTMBUHC-KGPDSPOASA-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 D (CHEBI:70289) has role metabolite (CHEBI:25212)
Torrubiellone D (CHEBI:70289) is a phenols (CHEBI:33853)
Synonym  Source
(3E)-3-[(2E,4E,6E)-1-hydroxy-8-(hydroxymethyl)deca-2,4,6-trienylidene]-5-[(4-hydroxyphenyl)methyl]pyrrolidine-2,4-dioneChEBI
Citations