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CHEBI:179894 - 7:0(6Me,6Me)

ChEBI IDCHEBI:179894
ChEBI Name7:0(6Me,6Me)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H18O2
Net Charge0
Average Mass158.241
Monoisotopic Mass158.13068
SMILESCC(C)(C)CCCCC(=O)O
InChIInChI=1S/C9H18O2/c1-9(2,3)7-5-4-6-8(10)11/h4-7H2,1-3H3,(H,10,11)
InChIKeyAAOISIQFPPAFQO-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
7:0(6Me,6Me) (CHEBI:179894) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
6,6-dimethylheptanoic acid
Manual XrefsDatabases
LMFA01020345LIPID MAPS
4956147ChemSpider
Registry NumbersSources
CAS:59354-78-8ChemIDplus