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CHEBI:216246 - Spiromastol K

Default Structure
ChEBI IDCHEBI:216246
ChEBI NameSpiromastol K
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O7
Net Charge0
Average Mass374.389
Monoisotopic Mass374.13655
SMILESCCCc1cc(O)cc(O)c1C(=O)Oc1cc(O)cc(CCC)c1C(=O)O
InChIInChI=1S/C20H22O7/c1-3-5-11-7-13(21)9-15(23)17(11)20(26)27-16-10-14(22)8-12(6-4-2)18(16)19(24)25/h7-10,21-23H,3-6H2,1-2H3,(H,24,25)
InChIKeyGYELDYQMOAGWNV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Spiromastigoides (ncbitaxon:37234) - PubMed (25913707)
ChEBI Ontology
Outgoing Relation(s)
Spiromastol K (CHEBI:216246) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
2-(2,4-dihydroxy-6-propylbenzoyl)oxy-4-hydroxy-6-propylbenzoic acid
Manual XrefsDatabases
35516949ChemSpider