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CHEBI:205981 - Xylarioic acid B

Default Structure
ChEBI IDCHEBI:205981
ChEBI NameXylarioic acid B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H22O5
Net Charge0
Average Mass234.292
Monoisotopic Mass234.14672
SMILESCCC(C)C(O)C(C)(O)C(O)C(C)C(=O)O
InChIInChI=1S/C11H22O5/c1-5-6(2)8(12)11(4,16)9(13)7(3)10(14)15/h6-9,12-13,16H,5H2,1-4H3,(H,14,15)
InChIKeyGQRHWZJLXPDUAP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - DOI (10.1002/hlca.200900323)
ChEBI Ontology
Outgoing Relation(s)
Xylarioic acid B (CHEBI:205981) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
3,4,5-trihydroxy-2,4,6-trimethyloctanoic acid
Manual XrefsDatabases
78444696ChemSpider