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CHEBI:167802 - (-)-Spiculisporic acid

Default Structure
ChEBI IDCHEBI:167802
ChEBI Name(-)-Spiculisporic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H28O6
Net Charge0
Average Mass328.405
Monoisotopic Mass328.18859
SMILESCCCCCCCCCC[C@H](C(=O)O)[C@]1(C(=O)O)CCC(=O)O1
InChIInChI=1S/C17H28O6/c1-2-3-4-5-6-7-8-9-10-13(15(19)20)17(16(21)22)12-11-14(18)23-17/h13H,2-12H2,1H3,(H,19,20)(H,21,22)/t13-,17+/m1/s1
InChIKeyTUXHHVJPGQUPCF-DYVFJYSZSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) MetaboLights (MTBLS2542)
ChEBI Ontology
Outgoing Relation(s)
(-)-Spiculisporic acid (CHEBI:167802) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(2S)-2-[(1S)-1-carboxyundecyl]-5-oxooxolane-2-carboxylic acid
Manual XrefsDatabases
66151ChemSpider
Registry NumbersSources
CAS:469-77-2ChemIDplus