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CHEBI:199677 - Exserolide D

ChEBI IDCHEBI:199677
ChEBI NameExserolide D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O6
Net Charge0
Average Mass294.303
Monoisotopic Mass294.11034
SMILESCCC[C@H]1C[C@H]2OC(=O)c3c(cc(O)c(OC)c3O)[C@H]2O1
InChIInChI=1S/C15H18O6/c1-3-4-7-5-10-13(20-7)8-6-9(16)14(19-2)12(17)11(8)15(18)21-10/h6-7,10,13,16-17H,3-5H2,1-2H3/t7-,10+,13+/m0/s1
InChIKeyZXWQOPCWRZRWHP-JVQVWZCXSA-N
Species of MetaboliteComponentSourceComments
Exserohilumspecies (ncbitaxon:1868163) - PubMed (24752143)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Exserolide D (CHEBI:199677) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
(2S,3aR,9bR)-6,8-dihydroxy-7-methoxy-2-propyl-2,3,3a,9b-tetrahydrouro[3,2-c]isochromen-5-one
Manual XrefsDatabases
40256856ChemSpider