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CHEBI:187402 - 4-[5]-ladderane-butanoic acid

ChEBI IDCHEBI:187402
ChEBI Name4-[5]-ladderane-butanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22O2
Net Charge0
Average Mass246.350
Monoisotopic Mass246.16198
SMILESO=C(O)CCCC1CC2C1C1C3C4CCC4C3C21
InChIInChI=1S/C16H22O2/c17-11(18)3-1-2-7-6-10-12(7)16-14-9-5-4-8(9)13(14)15(10)16/h7-10,12-16H,1-6H2,(H,17,18)
InChIKeyZDWWCRQXNJGGFF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
4-[5]-ladderane-butanoic acid (CHEBI:187402) is a fatty acid derivative (CHEBI:61697)
IUPAC Name 
4-(4-pentacyclo[6.4.0.02,7.03,6.09,12]dodecanyl)butanoic acid
Manual XrefsDatabases
24822044ChemSpider
LMFA01140011LIPID MAPS