CHEBI:202744 - Cladospolide E

ChEBI IDCHEBI:202744
ChEBI NameCladospolide E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC8H12O5
Net Charge0
Average Mass188.179
Monoisotopic Mass188.06847
SMILESCC1OC(=O)C(O)CCCOC1=O
InChIInChI=1S/C8H12O5/c1-5-7(10)12-4-2-3-6(9)8(11)13-5/h5-6,9H,2-4H2,1H3
InChIKeyHGGXTTRDEHPOBJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Cladosporiumspecies F14 (ncbitaxon:2753764) - DOI (10.1016/j.cclet.2010.06.026)
Cladosporiumspecies TZP29 (ncbitaxon:1686791) - PubMed (26169125)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Cladospolide E (CHEBI:202744) is a dicarboxylic acid (CHEBI:35692)
IUPAC Names 
(2E,4S,6E,11R)-4,11-dihydroxydodeca-2,6-dienoic acid
6-hydroxy-3-methyl-1,4-dioxonane-2,5-dione
Manual XrefsDatabases
27025326ChemSpider
40256490ChemSpider